Molecule

Lamivudine

AlkaPlorer ID: AK016711

Synonym: None

IUPAC Name: 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one

Structure

SMILES: NC1=NC(=O)N([C@@H]2CS[C@H](CO)O2)C=C1

InChI: InChI=1S/C8H11N3O3S/c9-5-1-2-11(8(13)10-5)6-4-15-7(3-12)14-6/h1-2,6-7,12H,3-4H2,(H2,9,10,13)/t6-,7+/m0/s1

InChIKey: JTEGQNOMFQHVDC-NKWVEPMBSA-N

Reference

Schisanwilsonenes A−C, Anti-HBV Carotane Sesquiterpenoids from the Fruits of <i>Schisandra wilsoniana</i>

PubChem CID: 60825

CAS: 134678-17-4

LOTUS: LTS0272395

NPASS: NPC469972

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Citrus bergamia	Citrus	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Sophora flavescens	Sophora	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 229.261

TPSA？: 90.37

MolLogP？: -0.5941000000000005

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Acinetobacter baumannii	Acinetobacter baumannii	Inhibition	11.08	%	10.6019/CHEMBL4513141
Anas sp.	Anas sp.	CC50	400000.0	nM	10.1016/0960-894X(96)00316-2
Anas sp.	Anas sp.	EC50	0.01	ug.mL-1	10.1021/jm010410d
Anas sp.	Anas sp.	IC50	100.0	nM	10.1016/0960-894X(96)00316-2
Anas sp.	Anas sp.	Inhibition	96.0	%	10.1021/jm010410d
Betapolyomavirus hominis	BK polyomavirus	EC50	100000.0	nM	10.1128/aac.01241-07
Bos taurus	Progesterone receptor	IC50	nan	None	None
Bos taurus	Progesterone receptor	Ki	nan	None	None
Candida albicans	Candida albicans	Inhibition	2.4	%	10.6019/CHEMBL4513141
Cavia porcellus	Leukotriene C4 synthase	IC50	nan	None	None
Cavia porcellus	Leukotriene C4 synthase	Ki	nan	None	None
Cavia porcellus	Serotonin 4 (5-HT4) receptor	IC50	nan	None	None
Cavia porcellus	Serotonin 4 (5-HT4) receptor	Ki	nan	None	None
Chlorocebus sabaeus	Vero	CC50	100.0	ug.mL-1	10.1016/s0960-894x(01)00589-3
Chlorocebus sabaeus	Vero	CC50	100.0	ug.mL-1	10.1021/jm010410d
Chlorocebus sabaeus	Vero	CC50	100000.0	nM	10.1016/j.bmc.2020.115952
Chlorocebus sabaeus	Vero	CC50	100000.0	nM	10.1016/j.bmcl.2017.01.010
Chlorocebus sabaeus	Vero	CC50	100000.0	nM	10.1016/j.ejmech.2017.06.062
Chlorocebus sabaeus	Vero	EC50	nan	ug.mL-1	10.1016/s0960-894x(01)00589-3
Chlorocebus sabaeus	Vero	IC50	100000.0	nM	10.1016/j.ejmech.2011.05.051
Chlorocebus sabaeus	Vero	IC50	100000.0	nM	10.1016/S0960-894X(01)81256-7
Chlorocebus sabaeus	Vero	IC50	100000.0	nM	10.1021/jm00070a006
Chlorocebus sabaeus	Vero	IC50	100000.0	nM	10.1021/jm990113x
Cowpox virus	Cowpox virus	IC50	436000.0	nM	10.1016/j.bmc.2008.11.075
Cryptococcus neoformans	Cryptococcus neoformans	Inhibition	-7.82	%	10.6019/CHEMBL4513141
Duck hepatitis B virus	Duck hepatitis B virus	Activity	95.0	%	10.1021/jm100803c
Duck hepatitis B virus	Duck hepatitis B virus	EC50	0.05	ug.mL-1	10.1016/j.bmc.2010.08.048
Duck hepatitis B virus	Duck hepatitis B virus	EC50	0.05	ug.mL-1	10.1016/j.bmcl.2012.08.042
Duck hepatitis B virus	Duck hepatitis B virus	EC50	40.0	nM	10.1021/jm058271d
Duck hepatitis B virus	Duck hepatitis B virus	EC50	40.0	nM	10.1021/jm060102l
Duck hepatitis B virus	Duck hepatitis B virus	EC50	44.0	nM	10.1021/jm100803c
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	52.7	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	57.1	%	10.1016/j.ejmech.2017.11.028
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	65.2	%	10.1016/j.ejmech.2017.11.028
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	75.6	%	10.1016/j.ejmech.2017.11.028
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	76.2	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	79.3	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	82.2	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	84.0	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	85.7	%	10.1016/j.ejmech.2017.11.028
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	88.6	%	10.1021/jm5012963
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	96.0	%	10.1016/j.bmc.2010.08.048
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	96.0	%	10.1016/j.bmcl.2012.08.042
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	96.0	%	10.1016/s0960-894x(01)00589-3
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	96.0	%	10.1021/jm058271d
Duck hepatitis B virus	Duck hepatitis B virus	Inhibition	96.0	%	10.1021/jm060102l
Escherichia coli	Escherichia coli	Inhibition	8.04	%	10.6019/CHEMBL4513141
Hepacivirus hominis	Hepatitis C virus	EC50	nan	nM	10.1021/jm034265a
Hepatitis B virus	Core antigen	Activity	4.0	%	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Core antigen	Activity	11.8	%	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Core antigen	Activity	23.9	%	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Core antigen	Activity	79.1	%	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Core antigen	EC50	370.0	nM	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Core antigen	EC50	10000.0	nM	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Core antigen	IC50	100.0	nM	10.1016/j.ejmech.2019.05.014
Hepatitis B virus	Core antigen	IC50	100000.0	nM	10.1016/j.ejmech.2019.05.014
Hepatitis B virus	Core antigen	Inhibition	1.0	%	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Core antigen	Inhibition	17.73	%	10.1016/j.ejmech.2019.05.014
Hepatitis B virus	Core antigen	Inhibition	90.67	%	10.1016/j.ejmech.2019.05.014
Hepatitis B virus	Core antigen	Inhibition	94.31	%	10.1016/j.ejmech.2019.05.014
Hepatitis B virus	Hepatitis B virus	Activity	40.0	%	10.1021/jm100803c
Hepatitis B virus	Hepatitis B virus	Activity	74.0	%	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Hepatitis B virus	Activity	77.32	%	10.1021/acs.jmedchem.2c00869
Hepatitis B virus	Hepatitis B virus	Activity	84.42	%	10.1016/j.ejmech.2022.114833
Hepatitis B virus	Hepatitis B virus	Activity	85.0	%	10.1021/jm100803c
Hepatitis B virus	Hepatitis B virus	Activity	nan	None	10.1021/acs.jmedchem.2c00869
Hepatitis B virus	Hepatitis B virus	Activity	nan	None	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	Activity	nan	None	10.1128/aac.00001-07
Hepatitis B virus	Hepatitis B virus	Activity	nan	None	10.1128/aac.01764-09
Hepatitis B virus	Hepatitis B virus	EC50	0.05	ug.mL-1	10.1016/j.bmcl.2010.08.120
Hepatitis B virus	Hepatitis B virus	EC50	0.062	ug.mL-1	10.1021/np010216u
Hepatitis B virus	Hepatitis B virus	EC50	0.2	ug.mL-1	10.1016/j.bmc.2010.08.048
Hepatitis B virus	Hepatitis B virus	EC50	0.2	ug.mL-1	10.1016/j.bmcl.2010.08.120
Hepatitis B virus	Hepatitis B virus	EC50	0.2	ug.mL-1	10.1016/j.bmcl.2012.08.042
Hepatitis B virus	Hepatitis B virus	EC50	3.8	nM	10.1021/acs.jmedchem.0c00292
Hepatitis B virus	Hepatitis B virus	EC50	8.0	nM	10.1021/jm990113x
Hepatitis B virus	Hepatitis B virus	EC50	8.87	nM	10.1021/acs.jmedchem.7b00416
Hepatitis B virus	Hepatitis B virus	EC50	10.0	nM	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Hepatitis B virus	EC50	20.0	nM	10.1016/j.bmcl.2023.129219
Hepatitis B virus	Hepatitis B virus	EC50	20.0	nM	10.1021/acs.jmedchem.7b00416
Hepatitis B virus	Hepatitis B virus	EC50	20.0	nM	10.1021/jm040093l
Hepatitis B virus	Hepatitis B virus	EC50	20.0	nM	10.1021/jm0607404
Hepatitis B virus	Hepatitis B virus	EC50	30.0	nM	10.1016/j.bmcl.2016.07.005
Hepatitis B virus	Hepatitis B virus	EC50	30.0	nM	10.1016/s0960-894x(98)00277-7
Hepatitis B virus	Hepatitis B virus	EC50	35.0	nM	10.1016/j.ejmech.2013.12.055
Hepatitis B virus	Hepatitis B virus	EC50	40.0	nM	10.1016/j.bmcl.2017.01.010
Hepatitis B virus	Hepatitis B virus	EC50	40.0	nM	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Hepatitis B virus	EC50	40.0	nM	10.1021/acs.jmedchem.2c00667
Hepatitis B virus	Hepatitis B virus	EC50	48.0	nM	10.1016/j.bmcl.2005.09.015
Hepatitis B virus	Hepatitis B virus	EC50	48.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	50.0	nM	10.1021/jm040149b
Hepatitis B virus	Hepatitis B virus	EC50	55.0	nM	10.1016/j.bmc.2016.12.017
Hepatitis B virus	Hepatitis B virus	EC50	56.0	nM	10.1016/j.bmcl.2012.11.027
Hepatitis B virus	Hepatitis B virus	EC50	60.0	nM	10.1016/j.bmcl.2011.01.109
Hepatitis B virus	Hepatitis B virus	EC50	60.0	nM	10.1016/j.ejmech.2011.05.051
Hepatitis B virus	Hepatitis B virus	EC50	60.0	nM	10.1021/jm058200e
Hepatitis B virus	Hepatitis B virus	EC50	70.0	nM	10.1021/acs.jmedchem.0c00292
Hepatitis B virus	Hepatitis B virus	EC50	100.0	nM	10.1016/j.bmc.2016.12.017
Hepatitis B virus	Hepatitis B virus	EC50	100.0	nM	10.1016/j.bmcl.2011.01.109
Hepatitis B virus	Hepatitis B virus	EC50	100.0	nM	10.1128/aac.00001-07
Hepatitis B virus	Hepatitis B virus	EC50	100.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	130.0	nM	10.1021/acs.jmedchem.2c00667
Hepatitis B virus	Hepatitis B virus	EC50	150.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	200.0	nM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC50	200.0	nM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC50	200.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	200.0	nM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC50	220.0	nM	10.1021/jm100803c
Hepatitis B virus	Hepatitis B virus	EC50	230.0	nM	10.1021/jm058200e
Hepatitis B virus	Hepatitis B virus	EC50	237.0	nM	10.1016/j.bmc.2016.12.017
Hepatitis B virus	Hepatitis B virus	EC50	251.0	nM	10.1016/j.bmcl.2005.09.015
Hepatitis B virus	Hepatitis B virus	EC50	300.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	300.0	nM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC50	325.0	nM	10.1016/j.ejmech.2021.113780
Hepatitis B virus	Hepatitis B virus	EC50	410.0	nM	10.1016/j.bmc.2020.115952
Hepatitis B virus	Hepatitis B virus	EC50	640.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	1000.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	1300.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	1500.0	nM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC50	1500.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	1600.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	1800.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	2100.0	nM	10.1021/jm058271d
Hepatitis B virus	Hepatitis B virus	EC50	2100.0	nM	10.1021/jm060102l
Hepatitis B virus	Hepatitis B virus	EC50	2480.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	2500.0	nM	10.1016/j.bmcl.2011.01.109
Hepatitis B virus	Hepatitis B virus	EC50	2650.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	5300.0	nM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC50	7700.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	10000.0	nM	10.1021/acs.jmedchem.0c00292
Hepatitis B virus	Hepatitis B virus	EC50	10000.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	16000.0	nM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC50	20000.0	nM	10.1016/j.bmc.2016.12.017
Hepatitis B virus	Hepatitis B virus	EC50	44000.0	nM	10.1021/jm058271d
Hepatitis B virus	Hepatitis B virus	EC50	44000.0	nM	10.1021/jm060102l
Hepatitis B virus	Hepatitis B virus	EC50	44000.0	nM	10.1021/jm100803c
Hepatitis B virus	Hepatitis B virus	EC50	80000.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	100000.0	nM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC50	100000.0	nM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC50	100000.0	nM	10.1021/jm801418v
Hepatitis B virus	Hepatitis B virus	EC50	100000.0	nM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC50	100000.0	nM	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	EC50	500000.0	nM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC50	500000.0	nM	10.1016/j.bmcl.2012.11.027
Hepatitis B virus	Hepatitis B virus	EC50	2399000.0	nM	10.1016/j.bmc.2015.09.006
Hepatitis B virus	Hepatitis B virus	EC50	nan	nM	10.1021/jm034265a
Hepatitis B virus	Hepatitis B virus	EC90	0.12	uM	10.1021/acs.jmedchem.2c00667
Hepatitis B virus	Hepatitis B virus	EC90	0.13	uM	10.1021/acs.jmedchem.2c00667
Hepatitis B virus	Hepatitis B virus	EC90	0.142	uM	10.1016/j.bmcl.2012.11.027
Hepatitis B virus	Hepatitis B virus	EC90	0.151	uM	10.1016/j.bmcl.2005.09.015
Hepatitis B virus	Hepatitis B virus	EC90	0.17	uM	10.1021/jm058200e
Hepatitis B virus	Hepatitis B virus	EC90	0.3	uM	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Hepatitis B virus	EC90	0.35	uM	10.1021/acs.jmedchem.2c00667
Hepatitis B virus	Hepatitis B virus	EC90	0.6	uM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC90	0.648	uM	10.1016/j.bmcl.2005.09.015
Hepatitis B virus	Hepatitis B virus	EC90	0.69	uM	10.1021/jm058200e
Hepatitis B virus	Hepatitis B virus	EC90	0.7	uM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC90	0.7	uM	10.1016/j.ejmech.2017.06.062
Hepatitis B virus	Hepatitis B virus	EC90	0.8	uM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC90	0.9	uM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC90	1.5	uM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC90	1.65	uM	10.1016/j.bmc.2020.115952
Hepatitis B virus	Hepatitis B virus	EC90	2.0	uM	10.1021/acs.jmedchem.7b00416
Hepatitis B virus	Hepatitis B virus	EC90	3.0	uM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC90	20.0	uM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC90	22.0	uM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC90	41.0	uM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC90	100.0	uM	10.1016/j.bmcl.2010.01.010
Hepatitis B virus	Hepatitis B virus	EC90	100.0	uM	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	EC90	100.0	uM	10.1128/aac.00114-09
Hepatitis B virus	Hepatitis B virus	EC90	2000.0	nM	10.1016/j.bmc.2016.12.017
Hepatitis B virus	Hepatitis B virus	EC90	nan	None	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	IC50	4.51	ug.mL-1	10.1016/j.bmc.2010.11.063
Hepatitis B virus	Hepatitis B virus	IC50	14.8	ug.mL-1	10.1016/j.ejmech.2010.01.032
Hepatitis B virus	Hepatitis B virus	IC50	25.0	nM	10.1021/acs.jmedchem.8b01245
Hepatitis B virus	Hepatitis B virus	IC50	31.0	nM	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	IC50	39.0	nM	10.1016/j.bmc.2015.07.039
Hepatitis B virus	Hepatitis B virus	IC50	41.0	ug.mL-1	10.1016/j.bmc.2014.12.064
Hepatitis B virus	Hepatitis B virus	IC50	49.13	ug.mL-1	10.1016/j.bmc.2014.12.064
Hepatitis B virus	Hepatitis B virus	IC50	50.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	80.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	100.0	nM	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	IC50	100.0	nM	10.1016/j.ejmech.2020.112581
Hepatitis B virus	Hepatitis B virus	IC50	100.0	nM	10.1016/j.ejmech.2022.114833
Hepatitis B virus	Hepatitis B virus	IC50	100.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	160.0	nM	10.1016/j.bmc.2010.05.076
Hepatitis B virus	Hepatitis B virus	IC50	200.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	220.0	nM	10.1016/j.bmcl.2009.10.119
Hepatitis B virus	Hepatitis B virus	IC50	260.0	nM	10.1016/j.ejmech.2014.01.046
Hepatitis B virus	Hepatitis B virus	IC50	330.0	nM	10.1016/j.bmc.2011.04.004
Hepatitis B virus	Hepatitis B virus	IC50	380.0	nM	10.1016/j.ejmech.2007.03.005
Hepatitis B virus	Hepatitis B virus	IC50	380.0	nM	10.1021/jm060330f
Hepatitis B virus	Hepatitis B virus	IC50	500.0	nM	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	IC50	600.0	nM	10.1016/j.ejmech.2020.112495
Hepatitis B virus	Hepatitis B virus	IC50	1000.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	2220.0	nM	10.1021/acsmedchemlett.9b00184
Hepatitis B virus	Hepatitis B virus	IC50	3000.0	nM	10.1073/pnas.0609883104
Hepatitis B virus	Hepatitis B virus	IC50	6860.0	nM	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	IC50	7630.0	nM	10.1016/j.ejmech.2014.11.050
Hepatitis B virus	Hepatitis B virus	IC50	14170.0	nM	10.1016/j.bmcl.2014.07.032
Hepatitis B virus	Hepatitis B virus	IC50	58000.0	nM	10.1021/np100745z
Hepatitis B virus	Hepatitis B virus	IC50	82420.0	nM	10.1016/j.bmc.2009.03.003
Hepatitis B virus	Hepatitis B virus	IC50	82420.0	nM	10.1016/j.bmc.2011.08.001
Hepatitis B virus	Hepatitis B virus	IC50	99450.0	nM	10.1016/j.bmcl.2013.01.046
Hepatitis B virus	Hepatitis B virus	IC50	100000.0	nM	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	IC50	100000.0	nM	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	IC50	100000.0	nM	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	IC50	100000.0	nM	10.1016/j.ejmech.2020.112495
Hepatitis B virus	Hepatitis B virus	IC50	100000.0	nM	10.1016/j.ejmech.2022.114833
Hepatitis B virus	Hepatitis B virus	IC50	141320.0	nM	10.1016/j.bmcl.2013.01.046
Hepatitis B virus	Hepatitis B virus	IC50	175930.0	nM	10.1016/j.bmcl.2013.01.046
Hepatitis B virus	Hepatitis B virus	IC50	234700.0	nM	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	IC50	240000.0	nM	10.1016/j.bmc.2009.05.001
Hepatitis B virus	Hepatitis B virus	IC50	240000.0	nM	10.1016/j.bmcl.2010.10.099
Hepatitis B virus	Hepatitis B virus	IC50	267160.0	nM	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	IC50	311200.0	nM	10.1016/j.bmc.2008.05.029
Hepatitis B virus	Hepatitis B virus	IC50	343200.0	nM	10.1016/j.ejmech.2014.01.046
Hepatitis B virus	Hepatitis B virus	IC50	405600.0	nM	10.1016/j.bmcl.2012.12.097
Hepatitis B virus	Hepatitis B virus	IC50	1000000.0	nM	10.1016/j.bmcl.2012.12.097
Hepatitis B virus	Hepatitis B virus	IC50	11700000.0	nM	10.1016/j.bmcl.2007.08.027
Hepatitis B virus	Hepatitis B virus	IC50	11700000.0	nM	10.1016/j.bmcl.2008.05.065
Hepatitis B virus	Hepatitis B virus	IC50	11700000.0	nM	10.1021/np070479+
Hepatitis B virus	Hepatitis B virus	IC50	13000000.0	nM	10.1016/j.bmcl.2009.10.006
Hepatitis B virus	Hepatitis B virus	IC50	18000000.0	nM	10.1016/j.bmcl.2009.02.122
Hepatitis B virus	Hepatitis B virus	IC50	22000000.0	nM	10.1016/j.bmcl.2009.10.006
Hepatitis B virus	Hepatitis B virus	IC50	25900000.0	nM	10.1016/j.bmcl.2007.08.027
Hepatitis B virus	Hepatitis B virus	IC50	25900000.0	nM	10.1016/j.bmcl.2008.05.065
Hepatitis B virus	Hepatitis B virus	IC50	25900000.0	nM	10.1021/np070479+
Hepatitis B virus	Hepatitis B virus	IC50	25940000.0	nM	10.1021/np200256b
Hepatitis B virus	Hepatitis B virus	IC50	27000000.0	nM	10.1016/j.ejmech.2010.11.019
Hepatitis B virus	Hepatitis B virus	IC50	28820000.0	nM	10.1016/j.bmcl.2013.01.118
Hepatitis B virus	Hepatitis B virus	IC50	30000000.0	nM	10.1016/j.ejmech.2010.11.019
Hepatitis B virus	Hepatitis B virus	IC50	30260000.0	nM	10.1021/np200256b
Hepatitis B virus	Hepatitis B virus	IC50	30350000.0	nM	10.1016/j.bmcl.2013.01.118
Hepatitis B virus	Hepatitis B virus	IC50	38000000.0	nM	10.1016/j.bmcl.2009.02.122
Hepatitis B virus	Hepatitis B virus	IC50	nan	None	10.1016/j.bmc.2009.05.001
Hepatitis B virus	Hepatitis B virus	IC50	nan	None	10.1016/j.bmcl.2010.10.099
Hepatitis B virus	Hepatitis B virus	IC50	nan	None	10.1016/j.ejmech.2010.01.032
Hepatitis B virus	Hepatitis B virus	Inhibition	0.81	%	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	Inhibition	4.0	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	4.1	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	6.3	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	7.9	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	7.98	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	8.4	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	9.09	%	10.1016/j.ejmech.2020.112581
Hepatitis B virus	Hepatitis B virus	Inhibition	10.0	%	10.1016/j.bmcl.2015.02.022
Hepatitis B virus	Hepatitis B virus	Inhibition	10.13	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	10.8	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	11.2	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	11.59	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	12.78	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	12.9	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	15.09	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	15.69	%	10.1016/j.ejmech.2020.112581
Hepatitis B virus	Hepatitis B virus	Inhibition	18.39	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	18.58	%	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	Inhibition	19.3	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	19.37	%	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	Inhibition	21.98	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	22.05	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	22.1	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	23.93	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	24.15	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	25.23	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	28.0	%	10.1021/jm101325h
Hepatitis B virus	Hepatitis B virus	Inhibition	28.56	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	28.6	%	10.1016/j.bmcl.2009.07.078
Hepatitis B virus	Hepatitis B virus	Inhibition	28.6	%	10.1021/np8007864
Hepatitis B virus	Hepatitis B virus	Inhibition	30.0	%	10.1021/jm058271d
Hepatitis B virus	Hepatitis B virus	Inhibition	30.0	%	10.1021/jm060102l
Hepatitis B virus	Hepatitis B virus	Inhibition	30.7	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	30.87	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	31.12	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	31.5	%	10.1021/acs.jnatprod.8b00576
Hepatitis B virus	Hepatitis B virus	Inhibition	32.7	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	33.11	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	34.17	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	34.5	%	10.1016/j.bmcl.2009.07.078
Hepatitis B virus	Hepatitis B virus	Inhibition	34.8	%	10.1021/np8007864
Hepatitis B virus	Hepatitis B virus	Inhibition	37.0	%	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	Inhibition	37.26	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	37.5	%	10.1021/acs.jnatprod.8b00576
Hepatitis B virus	Hepatitis B virus	Inhibition	38.57	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	39.6	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	39.92	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	39.97	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	42.4	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	43.59	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	45.0	%	10.1016/j.bmc.2012.07.028
Hepatitis B virus	Hepatitis B virus	Inhibition	45.0	%	10.1021/jm058271d
Hepatitis B virus	Hepatitis B virus	Inhibition	45.0	%	10.1021/jm060102l
Hepatitis B virus	Hepatitis B virus	Inhibition	45.36	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	45.96	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	46.0	%	10.1016/j.bmcl.2015.02.022
Hepatitis B virus	Hepatitis B virus	Inhibition	46.61	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	47.4	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	47.7	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	54.1	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	55.86	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	56.2	%	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	Inhibition	58.89	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	59.45	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	60.36	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	63.13	%	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	Inhibition	64.0	%	10.1021/jm101325h
Hepatitis B virus	Hepatitis B virus	Inhibition	66.83	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	69.42	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	69.7	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	70.0	%	10.1016/j.bmc.2020.115603
Hepatitis B virus	Hepatitis B virus	Inhibition	71.59	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	75.19	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	75.4	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	76.68	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	77.9	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	78.6	%	10.1016/j.bmcl.2019.04.005
Hepatitis B virus	Hepatitis B virus	Inhibition	80.8	%	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	Inhibition	81.64	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	81.9	%	10.1016/j.ejmech.2017.04.048
Hepatitis B virus	Hepatitis B virus	Inhibition	82.39	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	84.42	%	10.1016/j.ejmech.2020.112581
Hepatitis B virus	Hepatitis B virus	Inhibition	85.7	%	10.1016/j.ejmech.2017.11.028
Hepatitis B virus	Hepatitis B virus	Inhibition	86.23	%	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	Inhibition	86.39	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	87.9	%	10.1016/j.ejmech.2020.112495
Hepatitis B virus	Hepatitis B virus	Inhibition	88.0	%	10.1016/j.bmc.2010.08.048
Hepatitis B virus	Hepatitis B virus	Inhibition	88.0	%	10.1016/j.bmcl.2010.08.120
Hepatitis B virus	Hepatitis B virus	Inhibition	88.0	%	10.1016/j.bmcl.2012.08.042
Hepatitis B virus	Hepatitis B virus	Inhibition	88.0	%	10.1021/jm058271d
Hepatitis B virus	Hepatitis B virus	Inhibition	88.0	%	10.1021/jm060102l
Hepatitis B virus	Hepatitis B virus	Inhibition	90.0	%	10.1016/j.ejmech.2020.112581
Hepatitis B virus	Hepatitis B virus	Inhibition	90.01	%	10.1016/j.bmc.2020.115892
Hepatitis B virus	Hepatitis B virus	Inhibition	92.66	%	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	Inhibition	94.28	%	10.1016/j.ejmech.2017.12.042
Hepatitis B virus	Hepatitis B virus	Inhibition	95.86	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	96.0	%	10.1016/j.bmcl.2010.08.120
Hepatitis B virus	Hepatitis B virus	Inhibition	118.45	%	10.1016/j.ejmech.2015.03.056
Hepatitis B virus	Hepatitis B virus	Inhibition	nan	%	10.1016/j.bmc.2009.12.038
Hepatitis B virus	Hepatitis B virus	Inhibition	nan	%	10.1016/j.bmcl.2012.12.097
Hepatitis B virus	Hepatitis B virus	Inhibition	nan	%	10.1021/acsmedchemlett.9b00184
Hepatitis B virus	Hepatitis B virus	Ratio	1.5	None	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	Ratio	36.7	None	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	Ratio	166.0	None	10.1016/j.bmcl.2011.08.113
Hepatitis B virus	Hepatitis B virus	Ratio EC50	1.06	None	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	Ratio EC50	40.0	None	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	Ratio EC50	156.0	None	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	Ratio EC50	800.0	None	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	Ratio EC50	1000.0	None	10.1128/aac.01440-06
Hepatitis B virus	Hepatitis B virus	SI	3877.0	None	10.1021/jm058200e
Hepatitis B virus	Hepatitis B virus	SI	11630.0	None	10.1021/jm058200e
hepatitis B virus genotype D	HBV genotype D	Activity	48.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	80.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	82.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	88.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	506.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	902.0	%	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	Activity	nan	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	EC50	30.0	nM	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	EC50	410.0	nM	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	EC50	460.0	nM	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.04	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.06	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.27	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.33	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.34	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.35	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.38	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.54	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	0.65	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	1.4	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	3.27	None	10.1128/aac.01499-06
hepatitis B virus genotype D	HBV genotype D	FC	3.76	None	10.1128/aac.01499-06
Homo sapiens	786-0	GI50	1000000.0	nM	None
Homo sapiens	A498	GI50	93972.33	nM	None
Homo sapiens	A549	GI50	100000.0	nM	None
Homo sapiens	Acetylcholinesterase	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Acetylcholinesterase	IC50	nan	None	None
Homo sapiens	Acetylcholinesterase	Ki	nan	None	None
Homo sapiens	ACHN	GI50	254683.03	nM	None
Homo sapiens	Adenosine A1 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Adenosine A1 receptor	IC50	nan	None	None
Homo sapiens	Adenosine A1 receptor	Ki	nan	None	None
Homo sapiens	Adenosine A2a receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Adenosine A2a receptor	IC50	nan	None	None
Homo sapiens	Adenosine A2a receptor	Ki	nan	None	None
Homo sapiens	Adenosine A3 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Adenosine A3 receptor	IC50	nan	None	None
Homo sapiens	Adenosine A3 receptor	Ki	nan	None	None
Homo sapiens	Alpha-1a adrenergic receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-1a adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-1d adrenergic receptor	IC50	nan	None	None
Homo sapiens	Alpha-1d adrenergic receptor	Ki	nan	None	None
Homo sapiens	Alpha-2a adrenergic receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-2a adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-2a adrenergic receptor	IC50	nan	None	None
Homo sapiens	Alpha-2a adrenergic receptor	Ki	nan	None	None
Homo sapiens	Alpha-2b adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-2b adrenergic receptor	IC50	nan	None	None
Homo sapiens	Alpha-2b adrenergic receptor	Ki	nan	None	None
Homo sapiens	Alpha-2c adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Alpha-2c adrenergic receptor	IC50	nan	None	None
Homo sapiens	Alpha-2c adrenergic receptor	Ki	nan	None	None
Homo sapiens	Androgen Receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Angiotensin II type 2 (AT-2) receptor	IC50	nan	None	None
Homo sapiens	Angiotensin II type 2 (AT-2) receptor	Ki	nan	None	None
Homo sapiens	ATP-binding cassette sub-family G member 2	Activity	nan	None	10.1124/mol.63.1.65
Homo sapiens	Beta-1 adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Beta-1 adrenergic receptor	IC50	nan	None	None
Homo sapiens	Beta-1 adrenergic receptor	Ki	nan	None	None
Homo sapiens	Beta-2 adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Beta-2 adrenergic receptor	IC50	nan	None	None
Homo sapiens	Beta-2 adrenergic receptor	Ki	nan	None	None
Homo sapiens	Beta-3 adrenergic receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Beta-3 adrenergic receptor	IC50	nan	None	None
Homo sapiens	Beta-3 adrenergic receptor	Ki	nan	None	None
Homo sapiens	Bile salt export pump	AC50	300000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Bile salt export pump	IC50	133000.0	nM	10.1093/toxsci/kft176
Homo sapiens	Bradykinin B1 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Bradykinin B2 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Bradykinin B2 receptor	IC50	nan	None	None
Homo sapiens	Bradykinin B2 receptor	Ki	nan	None	None
Homo sapiens	BT-549	GI50	1000000.0	nM	None
Homo sapiens	C8166	CC50	1000000.0	nM	10.1021/acs.jnatprod.9b00022
Homo sapiens	Caco-2	IC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Homo sapiens	CAKI-1	GI50	58748.94	nM	None
Homo sapiens	Calcitonin receptor	IC50	nan	None	None
Homo sapiens	Calcitonin receptor	Ki	nan	None	None
Homo sapiens	Canalicular multispecific organic anion transporter 1	Activity	nan	None	10.1124/dmd.106.012765
Homo sapiens	Canalicular multispecific organic anion transporter 1	IC50	133000.0	nM	10.1093/toxsci/kft176
Homo sapiens	Canalicular multispecific organic anion transporter 2	Activity	nan	None	10.1124/dmd.106.012765
Homo sapiens	Canalicular multispecific organic anion transporter 2	IC50	133000.0	nM	10.1093/toxsci/kft176
Homo sapiens	Cannabinoid CB1 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cannabinoid CB1 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cannabinoid CB1 receptor	IC50	nan	None	None
Homo sapiens	Cannabinoid CB1 receptor	Ki	nan	None	None
Homo sapiens	Carbonic anhydrase II	IC50	nan	None	None
Homo sapiens	Carbonic anhydrase II	Ki	nan	None	None
Homo sapiens	Caspase-1	IC50	nan	None	None
Homo sapiens	Caspase-1	Ki	nan	None	None
Homo sapiens	Cathepsin G	IC50	nan	None	None
Homo sapiens	Cathepsin G	Ki	nan	None	None
Homo sapiens	C-C chemokine receptor type 2	IC50	nan	None	None
Homo sapiens	C-C chemokine receptor type 2	Ki	nan	None	None
Homo sapiens	C-C chemokine receptor type 4	IC50	nan	None	None
Homo sapiens	C-C chemokine receptor type 4	Ki	nan	None	None
Homo sapiens	C-C chemokine receptor type 5	IC50	nan	None	None
Homo sapiens	C-C chemokine receptor type 5	Ki	nan	None	None
Homo sapiens	CCRF-CEM	Activity	0.41	pmol	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	Activity	0.67	pmol	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	Activity	74.0	%	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	Activity	83.0	%	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	Activity	92.0	%	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	Activity	nan	None	10.1128/aac.01543-06
Homo sapiens	CCRF-CEM	CC50	100000.0	nM	10.1016/j.bmc.2020.115952
Homo sapiens	CCRF-CEM	CC50	100000.0	nM	10.1016/j.bmcl.2017.01.010
Homo sapiens	CCRF-CEM	CC50	100000.0	nM	10.1016/j.ejmech.2017.06.062
Homo sapiens	CCRF-CEM	CC50	100000.0	nM	10.1021/jm040093l
Homo sapiens	CCRF-CEM	CC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Homo sapiens	CCRF-CEM	CC50	363000.0	nM	10.1016/S0960-894X(97)00178-9
Homo sapiens	CCRF-CEM	GI50	93325.43	nM	None
Homo sapiens	CCRF-CEM	IC50	50000.0	nM	10.1016/0960-894X(95)00343-R
Homo sapiens	CCRF-CEM	IC50	100000.0	nM	10.1016/j.ejmech.2011.05.051
Homo sapiens	CCRF-CEM	IC50	100000.0	nM	10.1021/jm9703698
Homo sapiens	CCRF-CEM	IC50	100000.0	nM	10.1021/jm990113x
Homo sapiens	CCRF-CEM	IC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Homo sapiens	CCRF-CEM	IC50	nan	nM	10.1016/0960-894X(95)00343-R
Homo sapiens	CCRF-CEM	ID50	50.0	uM	10.1016/s0960-894x(98)00277-7
Homo sapiens	CCRF-CEM	ID50	nan	None	10.1021/jm034265a
Homo sapiens	CEM-SS	Activity	nan	None	10.1021/np030469i
Homo sapiens	CEM-SS	TC50	500.0	nM	10.1016/j.bmcl.2012.07.037
Homo sapiens	Cholecystokinin A receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cholecystokinin A receptor	IC50	nan	None	None
Homo sapiens	Cholecystokinin A receptor	Ki	nan	None	None
Homo sapiens	Cholecystokinin B receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	COLO 205	GI50	100000.0	nM	None
Homo sapiens	COLO 320	IC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Homo sapiens	Corticotropin releasing factor receptor 1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Corticotropin releasing factor receptor 2	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cyclooxygenase-1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cyclooxygenase-1	IC50	nan	None	None
Homo sapiens	Cyclooxygenase-1	Ki	nan	None	None
Homo sapiens	Cyclooxygenase-2	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Cyclooxygenase-2	IC50	nan	None	None
Homo sapiens	Cyclooxygenase-2	Ki	nan	None	None
Homo sapiens	Cysteinyl leukotriene receptor 1	IC50	nan	None	None
Homo sapiens	Cysteinyl leukotriene receptor 1	Ki	nan	None	None
Homo sapiens	Cytochrome P450 1A2	IC50	nan	None	None
Homo sapiens	Cytochrome P450 1A2	Ki	nan	None	None
Homo sapiens	Cytochrome P450 2A6	IC50	nan	None	None
Homo sapiens	Cytochrome P450 2A6	Ki	nan	None	None
Homo sapiens	Cytochrome P450 2C19	IC50	nan	None	None
Homo sapiens	Cytochrome P450 2C19	Ki	nan	None	None
Homo sapiens	Cytochrome P450 2C9	FC	1.0	None	10.1016/j.bmcl.2016.06.088
Homo sapiens	Cytochrome P450 2C9	IC50	nan	None	None
Homo sapiens	Cytochrome P450 2C9	Ki	nan	None	None
Homo sapiens	Cytochrome P450 2D6	FC	1.0	None	10.1016/j.bmcl.2016.06.088
Homo sapiens	Cytochrome P450 2D6	IC50	nan	None	None
Homo sapiens	Cytochrome P450 2D6	Ki	nan	None	None
Homo sapiens	Cytochrome P450 2E1	IC50	nan	None	None
Homo sapiens	Cytochrome P450 2E1	Ki	nan	None	None
Homo sapiens	Cytochrome P450 3A4	FC	1.0	None	10.1016/j.bmcl.2016.06.088
Homo sapiens	Cytochrome P450 3A4	IC50	nan	None	None
Homo sapiens	Cytochrome P450 3A4	Ki	nan	None	None
Homo sapiens	Daudi	IC50	nan	None	10.1021/jm010410d
Homo sapiens	Delta opioid receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Delta opioid receptor	IC50	nan	None	None
Homo sapiens	Delta opioid receptor	Ki	nan	None	None
Homo sapiens	DLD-1	GI50	100000.0	nM	None
Homo sapiens	DMS-114	GI50	100000.0	nM	None
Homo sapiens	DMS-273	GI50	100000.0	nM	None
Homo sapiens	Dopamine D1 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine D1 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine D1 receptor	IC50	nan	None	None
Homo sapiens	Dopamine D1 receptor	Ki	nan	None	None
Homo sapiens	Dopamine D2 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine D2 receptor	IC50	nan	None	None
Homo sapiens	Dopamine D2 receptor	Ki	nan	None	None
Homo sapiens	Dopamine D3 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine D3 receptor	IC50	nan	None	None
Homo sapiens	Dopamine D3 receptor	Ki	nan	None	None
Homo sapiens	Dopamine D4 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine D4 receptor	IC50	nan	None	None
Homo sapiens	Dopamine D4 receptor	Ki	nan	None	None
Homo sapiens	Dopamine D5 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine transporter	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Dopamine transporter	IC50	nan	None	None
Homo sapiens	Dopamine transporter	Ki	nan	None	None
Homo sapiens	DU-145	GI50	1000000.0	nM	None
Homo sapiens	EKVX	GI50	79432.82	nM	None
Homo sapiens	Endothelin receptor ET-A	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Endothelin receptor ET-A	IC50	nan	None	None
Homo sapiens	Endothelin receptor ET-A	Ki	nan	None	None
Homo sapiens	Endothelin receptor ET-B	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Epidermal growth factor receptor erbB1	IC50	nan	None	None
Homo sapiens	Epidermal growth factor receptor erbB1	Ki	nan	None	None
Homo sapiens	Equilibrative nucleoside transporter 1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Estrogen receptor alpha	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Estrogen receptor alpha	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Estrogen receptor alpha	IC50	nan	None	None
Homo sapiens	Estrogen receptor alpha	Ki	nan	None	None
Homo sapiens	Estrogen receptor beta	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Estrogen receptor beta	IC50	nan	None	None
Homo sapiens	Estrogen receptor beta	Ki	nan	None	None
Homo sapiens	GABA-B receptor 1	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Gastric inhibitory polypeptide receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Ghrelin receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Glucagon receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Glucocorticoid receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Glucocorticoid receptor	IC50	nan	None	None
Homo sapiens	Glucocorticoid receptor	Ki	nan	None	None
Homo sapiens	H9	CC50	200000.0	nM	10.1016/j.ejmech.2021.113680
Homo sapiens	HCC 2998	GI50	87297.14	nM	None
Homo sapiens	HCT-116	GI50	100000.0	nM	None
Homo sapiens	HCT-15	GI50	100000.0	nM	None
Homo sapiens	HEK293	CC50	25000.0	nM	10.1021/acs.jmedchem.0c00940
Homo sapiens	HeLa	CC50	20000.0	nM	10.1016/j.bmcl.2015.01.058
Homo sapiens	HeLa	EC50	436000.0	nM	10.1021/jm201551m
Homo sapiens	HeLa	EC50	436600.0	nM	10.1021/jm300492q
Homo sapiens	HeLa	IC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Homo sapiens	HepG2	Activity	0.6	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Activity	83.0	%	10.1021/acs.jmedchem.8b01300
Homo sapiens	HepG2	Activity	91.0	%	10.1021/jm501874e
Homo sapiens	HepG2	Activity	105.0	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Activity	119.0	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Activity	120.0	%	10.1021/acs.jmedchem.7b00067
Homo sapiens	HepG2	Activity	140.0	%	10.1021/acs.jmedchem.7b00067
Homo sapiens	HepG2	Activity	416.0	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Activity	nan	None	10.1016/j.bmcl.2012.11.027
Homo sapiens	HepG2	Activity	nan	None	10.1021/jm501874e
Homo sapiens	HepG2	CC50	10000.0	nM	10.1016/j.bmcl.2017.01.010
Homo sapiens	HepG2	CC50	10000.0	nM	10.1016/j.ejmech.2017.06.062
Homo sapiens	HepG2	CC50	10000.0	nM	10.1021/jm501874e
Homo sapiens	HepG2	CC50	25000.0	nM	10.1016/j.bmcl.2011.01.109
Homo sapiens	HepG2	CC50	100000.0	nM	10.1016/j.bmc.2020.115952
Homo sapiens	HepG2	CC50	100000.0	nM	10.1021/acs.jmedchem.0c00292
Homo sapiens	HepG2	CC50	100000.0	nM	10.1021/jm0607404
Homo sapiens	HepG2	CC50	100000.0	nM	10.1073/pnas.0609883104
Homo sapiens	HepG2	CC50	500000.0	nM	10.1021/acs.jmedchem.2c00869
Homo sapiens	HepG2	CC50	1000000.0	nM	10.1021/jm060330f
Homo sapiens	HepG2	CC50	1200000.0	nM	10.1128/aac.00001-07
Homo sapiens	HepG2	CC50	2159000.0	nM	10.1016/j.bmcl.2005.09.015
Homo sapiens	HepG2	CC50	2176000.0	nM	10.1016/j.bmc.2015.07.039
Homo sapiens	HepG2	EC50	8.0	nM	10.1021/jm9703698
Homo sapiens	HepG2	EC50	38.0	nM	10.1016/S0960-894X(97)00422-8
Homo sapiens	HepG2	EC50	200.0	nM	10.1016/S0960-894X(96)00594-X
Homo sapiens	HepG2	EC50	200.0	nM	10.1021/jm0309708
Homo sapiens	HepG2	EC50	400.0	nM	10.1016/s0960-894x(03)00496-7
Homo sapiens	HepG2	EC90	0.16	uM	10.1016/S0960-894X(97)00422-8
Homo sapiens	HepG2	IC50	10000.0	nM	10.1021/acs.jmedchem.7b00067
Homo sapiens	HepG2	IC50	10000.0	nM	10.1021/acs.jmedchem.8b01300
Homo sapiens	HepG2	IC50	1792000.0	nM	10.1016/S0960-894X(97)00422-8
Homo sapiens	HepG2	Inhibition	1.0	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Inhibition	10.0	%	10.1021/acs.jmedchem.8b01300
Homo sapiens	HepG2	Inhibition	16.0	%	10.1021/acs.jmedchem.7b00067
Homo sapiens	HepG2	Inhibition	38.0	%	10.1021/acs.jmedchem.7b00067
Homo sapiens	HepG2	Inhibition	87.0	%	10.1016/S0960-894X(01)81256-7
Homo sapiens	HepG2	Inhibition	94.3	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Inhibition	99.96	%	10.1128/aac.00392-09
Homo sapiens	HepG2	Selectivity index	2632.0	None	10.1021/jm060330f
Homo sapiens	HepG2	Selectivity index	8602.0	None	10.1016/j.bmcl.2005.09.015
Homo sapiens	HepG2	Selectivity index	44979.0	None	10.1016/j.bmcl.2005.09.015
Homo sapiens	HepG2 2.2.15	Activity	12.7	%	10.1016/j.ejmech.2020.112495
Homo sapiens	HepG2 2.2.15	CC50	2000.0	nM	10.1016/j.bmcl.2023.129219
Homo sapiens	HepG2 2.2.15	CC50	2000.0	nM	10.1021/acs.jmedchem.2c00667
Homo sapiens	HepG2 2.2.15	CC50	2000.0	nM	10.1021/acs.jmedchem.7b00416
Homo sapiens	HepG2 2.2.15	CC50	20000.0	nM	10.1016/j.ejmech.2022.114833
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.bmc.2020.115892
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2017.04.048
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2017.12.042
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2019.05.014
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2020.112495
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2020.112581
Homo sapiens	HepG2 2.2.15	CC50	100000.0	nM	10.1016/j.ejmech.2022.114159
Homo sapiens	HepG2 2.2.15	CC50	218100.0	nM	10.1021/acsmedchemlett.9b00184
Homo sapiens	HepG2 2.2.15	CC50	568250.0	nM	10.1016/j.ejmech.2015.03.056
Homo sapiens	HepG2 2.2.15	CC50	1000000.0	nM	10.1016/j.ejmech.2017.11.028
Homo sapiens	HepG2 2.2.15	CC50	1020000.0	nM	10.1016/j.bmc.2016.12.017
Homo sapiens	HepG2 2.2.15	CC50	2124000.0	nM	10.1021/acs.jmedchem.2c00667
Homo sapiens	HepG2 2.2.15	Inhibition	87.0	%	10.1016/j.ejmech.2022.114159
Homo sapiens	HERG	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	HERG	IC50	nan	None	None
Homo sapiens	HERG	Ki	nan	None	None
Homo sapiens	HFF	IC50	nan	None	10.1021/jm010410d
Homo sapiens	Histamine H1 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Histamine H1 receptor	IC50	nan	None	None
Homo sapiens	Histamine H1 receptor	Ki	nan	None	None
Homo sapiens	Histamine H2 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Histamine H2 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Histamine H2 receptor	IC50	nan	None	None
Homo sapiens	Histamine H2 receptor	Ki	nan	None	None
Homo sapiens	Histamine H3 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Histone deacetylase 6	Inhibition	-79.38	%	10.6019/CHEMBL4808148
Homo sapiens	Histone deacetylase 6	Inhibition	3.31	%	10.6019/CHEMBL4808148
Homo sapiens	HL-60	CC50	1400000.0	nM	10.1128/aac.00001-07
Homo sapiens	HL-60	GI50	79432.82	nM	None
Homo sapiens	HMG-CoA reductase	IC50	nan	None	None
Homo sapiens	HMG-CoA reductase	Ki	nan	None	None
Homo sapiens	Homo sapiens	Activity	0.85	%	10.1016/j.ejmech.2009.11.034
Homo sapiens	Homo sapiens	AUC	0.03531	ng.hr.mL-1	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	AUC	0.03691	ng.hr.mL-1	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	AUC	9.8	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	10.42	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	AUC	65.19	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	AUC	70.01	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	AUC	3710.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	4440.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	5420.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	6540.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	7800.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	8100.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	9100.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	9800.0	ng.hr.mL-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	AUC	15500.0	ng.hr.mL-1	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	AUC	15700.0	ng.hr.mL-1	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	CC50	100000.0	nM	10.1021/jm040149b
Homo sapiens	Homo sapiens	CL	1.4	mL.min-1.kg-1	10.1021/jm901371v
Homo sapiens	Homo sapiens	CL	4.8	mL.min-1.kg-1	10.1021/jm900403j
Homo sapiens	Homo sapiens	CL	4.8	mL.min-1.kg-1	10.1021/jm901371v
Homo sapiens	Homo sapiens	CL/F	9.5	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	13.33	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	15.0	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	15.83	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	17.17	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	18.67	mL.min-1.kg-1	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	CL/F	20.2	L/hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	CL/F	20.3	L/hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	CL_renal	3.36	mL.min-1.kg-1	10.1021/jm900403j
Homo sapiens	Homo sapiens	CL_renal	3.4	mL.min-1.kg-1	10.1021/jm901371v
Homo sapiens	Homo sapiens	CL_renal	13.1	L/hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	CL_renal	14.5	L/hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmax	0.00076	nM	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmax	0.004424	nM	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmax	0.00484	nM	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmax	9.83	pmol/10^6cells	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmax	9.91	pmol/10^6cells	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmax	4274.62	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	4841.66	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	5801.27	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	7415.16	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	8025.82	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	9116.29	nM	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmax	16618.69	nM	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmax	17360.2	nM	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmin	0.04	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmin	0.05	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmin	0.067	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmin	0.07	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmin	0.09	mg/L	10.1128/aac.00306-10
Homo sapiens	Homo sapiens	Cmin	249.0	fmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmin	1002.0	fmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmin	1055.0	fmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Cmin_PBMC	4.35	pmol/10^6cells	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Cmin_PBMC	4.52	pmol/10^6cells	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	DILI_Concern	nan	None	10.1016/j.drudis.2016.02.015
Homo sapiens	Homo sapiens	DILI_severity_class	3.0	None	10.1016/j.drudis.2016.02.015
Homo sapiens	Homo sapiens	Drug uptake	282.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	302.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	396.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	437.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	1115.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	1934.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	2163.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Drug uptake	2393.0	pmol	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	F	86.0	%	10.1016/j.bmc.2007.08.060
Homo sapiens	Homo sapiens	Fa	1.0	None	10.1021/jm901371v
Homo sapiens	Homo sapiens	F_fraction	0.87	None	10.1021/jm901371v
Homo sapiens	Homo sapiens	Fg	0.93	None	10.1021/jm901371v
Homo sapiens	Homo sapiens	Fh	0.94	None	10.1021/jm901371v
Homo sapiens	Homo sapiens	IC50	50.0	ug.mL-1	10.1016/s0960-894x(01)00589-3
Homo sapiens	Homo sapiens	Ratio	2.32	None	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Ratio	2.41	None	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	T1/2	4.53	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	T1/2	4.57	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	T1/2	5.0	hr	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	T1/2	17.7	hr	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	T1/2	19.1	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	T1/2	23.9	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Tmax	1.0	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Tmax	1.02	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Tmax	3.9	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Tmax	4.76	hr	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Tmax	6.3	hr	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Tmax	6.37	hr	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Tmax	6.67	hr	10.1128/aac.01626-06
Homo sapiens	Homo sapiens	Vdss	1.3	L.kg-1	10.1016/j.ejmech.2009.06.004
Homo sapiens	Homo sapiens	Vdss	1.3	L.kg-1	10.1021/jm901371v
Homo sapiens	Homo sapiens	Vdss	128.0	l	10.1128/aac.01013-06
Homo sapiens	Homo sapiens	Vdss	135.0	l	10.1128/aac.01013-06
Homo sapiens	HOP-18	GI50	100000.0	nM	None
Homo sapiens	HOP-62	GI50	100000.0	nM	None
Homo sapiens	HOP-92	GI50	100000.0	nM	None
Homo sapiens	Hs-578T	GI50	1000000.0	nM	None
Homo sapiens	HT-29	GI50	100000.0	nM	None
Homo sapiens	Huh-7	CC50	100.0	nM	10.1016/j.bmcl.2011.01.109
Homo sapiens	Huh-7	CC50	300000.0	nM	10.1016/j.bmcl.2012.11.027
Homo sapiens	Huh-7	CC50	nan	None	10.1016/j.bmcl.2012.08.042
Homo sapiens	Huh-7	TC50	2360.9	uM	10.1021/acs.jnatprod.6b00671
Homo sapiens	IGROV-1	GI50	100000.0	nM	None
Homo sapiens	Interleukin-8 receptor A	IC50	nan	None	None
Homo sapiens	Interleukin-8 receptor A	Ki	nan	None	None
Homo sapiens	Interleukin-8 receptor B	IC50	nan	None	None
Homo sapiens	Interleukin-8 receptor B	Ki	nan	None	None
Homo sapiens	K562	GI50	100000.0	nM	None
Homo sapiens	Kappa opioid receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Kappa opioid receptor	IC50	nan	None	None
Homo sapiens	Kappa opioid receptor	Ki	nan	None	None
Homo sapiens	KM12	GI50	76032.63	nM	None
Homo sapiens	KM-20L2	GI50	100000.0	nM	None
Homo sapiens	Leukocyte common antigen	IC50	nan	None	None
Homo sapiens	Leukocyte common antigen	Ki	nan	None	None
Homo sapiens	Leukocyte elastase	IC50	nan	None	None
Homo sapiens	Leukocyte elastase	Ki	nan	None	None
Homo sapiens	LOX IMVI	GI50	100000.0	nM	None
Homo sapiens	M14	GI50	1000000.0	nM	None
Homo sapiens	M19-MEL	GI50	100000.0	nM	None
Homo sapiens	Malme-3M	GI50	100000.0	nM	None
Homo sapiens	MAP kinase ERK1	IC50	nan	None	None
Homo sapiens	MAP kinase ERK1	Ki	nan	None	None
Homo sapiens	MAP kinase ERK2	IC50	nan	None	None
Homo sapiens	MAP kinase ERK2	Ki	nan	None	None
Homo sapiens	MAP kinase p38 alpha	IC50	nan	None	None
Homo sapiens	MAP kinase p38 alpha	Ki	nan	None	None
Homo sapiens	Matrix metalloproteinase-1	IC50	nan	None	None
Homo sapiens	Matrix metalloproteinase-1	Ki	nan	None	None
Homo sapiens	Matrix metalloproteinase 9	IC50	nan	None	None
Homo sapiens	Matrix metalloproteinase 9	Ki	nan	None	None
Homo sapiens	MCF7	GI50	100000.0	nM	None
Homo sapiens	MDA-MB-231	GI50	1000000.0	nM	None
Homo sapiens	MDA-MB-435	GI50	1000000.0	nM	None
Homo sapiens	MDA-N	GI50	1000000.0	nM	None
Homo sapiens	Melanocortin receptor 3	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Melanocortin receptor 3	IC50	nan	None	None
Homo sapiens	Melanocortin receptor 3	Ki	nan	None	None
Homo sapiens	Melanocortin receptor 4	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Melanocortin receptor 4	IC50	nan	None	None
Homo sapiens	Melanocortin receptor 4	Ki	nan	None	None
Homo sapiens	Melanocortin receptor 5	IC50	nan	None	None
Homo sapiens	Melanocortin receptor 5	Ki	nan	None	None
Homo sapiens	Microtubule-associated protein tau	Potency	3548.1	nM	None
Homo sapiens	MOLT-4	GI50	100000.0	nM	None
Homo sapiens	Monoamine oxidase A	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Monoamine oxidase A	IC50	nan	None	None
Homo sapiens	Monoamine oxidase A	Ki	nan	None	None
Homo sapiens	Motilin receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	MT2	ID50	nan	None	10.1021/jm034265a
Homo sapiens	MT4	CC50	20.0	ug.mL-1	10.1016/j.ejmech.2016.04.019
Homo sapiens	MT4	CC50	7500.0	nM	10.1016/j.ejmech.2019.111864
Homo sapiens	MT4	CC50	20000.0	nM	10.1016/j.ejmech.2021.113868
Homo sapiens	MT4	CC50	42000.0	nM	10.1021/acs.jmedchem.8b00141
Homo sapiens	MT4	CC50	44000.0	nM	10.1016/s0960-894x(03)00496-7
Homo sapiens	MT4	CC50	44000.0	nM	10.1021/jm0309708
Homo sapiens	MT4	CC50	87000.0	nM	10.1016/j.bmc.2013.09.009
Homo sapiens	MT4	CC50	87000.0	nM	10.1016/j.ejmech.2015.01.042
Homo sapiens	MT4	CC50	87000.0	nM	10.1016/j.ejmech.2015.02.022
Homo sapiens	MT4	CC50	87000.0	nM	10.1021/acs.jnatprod.5b00116
Homo sapiens	MT4	CC50	87000.0	nM	10.1021/np500271u
Homo sapiens	MT4	CC50	87200.0	nM	10.1016/j.bmc.2014.03.020
Homo sapiens	MT4	CC50	87200.0	nM	10.1016/j.bmc.2017.06.022
Homo sapiens	MT4	CC50	87200.0	nM	10.1016/j.ejmech.2020.112811
Homo sapiens	MT4	CC50	87200.0	nM	10.1021/acs.jmedchem.8b01729
Homo sapiens	MT4	CC50	87240.0	nM	10.1016/j.bmc.2014.11.032
Homo sapiens	MT4	CC50	87240.0	nM	10.1016/j.ejmech.2014.05.059
Homo sapiens	MT4	CC50	87240.0	nM	10.1016/j.ejmech.2014.09.054
Homo sapiens	MT4	CC50	87240.0	nM	10.1016/j.ejmech.2019.111619
Homo sapiens	MT4	CC50	87240.0	nM	10.1016/j.ejmech.2020.113051
Homo sapiens	MT4	CC50	87240.0	nM	10.1021/acs.jmedchem.2c00667
Homo sapiens	MT4	CC50	87300.0	nM	10.1016/j.bmc.2018.12.039
Homo sapiens	MT4	CC50	87300.0	nM	10.1016/j.ejmech.2022.114563
Homo sapiens	MT4	CC50	100000.0	nM	10.1016/0960-894X(96)00316-2
Homo sapiens	MT4	CC50	405000.0	nM	10.1016/S0960-894X(97)00178-9
Homo sapiens	MT4	CC50	407000.0	nM	10.1016/S0960-894X(97)00178-9
Homo sapiens	MT4	CD50	100.0	ug ml-1	10.1016/S0960-894X(00)80050-5
Homo sapiens	MT4	EC50	400.0	nM	10.1016/s0960-894x(03)00496-7
Homo sapiens	MT4	EC50	500.0	nM	10.1021/jm0309708
Homo sapiens	MT4	EC50	7000.0	nM	10.1016/S0960-894X(01)81256-7
Homo sapiens	MT4	IC50	0.048	ug.mL-1	10.1021/jm00010a010
Homo sapiens	MT4	IC50	100.0	nM	10.1016/0960-894X(96)00316-2
Homo sapiens	MT4	IC50	100.0	nM	10.1021/jm00040a014
Homo sapiens	MT4	IC50	100.0	ug.mL-1	10.1021/jm00010a010
Homo sapiens	MT4	IC50	370.0	nM	10.1016/S0960-894X(97)00178-9
Homo sapiens	MT4	IC50	610.0	nM	10.1016/S0960-894X(97)00178-9
Homo sapiens	MT4	ID50	0.13	ug ml-1	10.1016/S0960-894X(00)80050-5
Homo sapiens	MT4	SI	0.862	None	10.1021/jm0309708
Homo sapiens	MT4	SI	88.0	None	10.1021/jm0309708
Homo sapiens	Multidrug resistance-associated protein 1	Activity	nan	None	10.1097/00002030-200209060-00005
Homo sapiens	Multidrug resistance-associated protein 1	Activity	nan	None	10.1124/dmd.106.012765
Homo sapiens	Multidrug resistance-associated protein 4	IC50	133000.0	nM	10.1093/toxsci/kft176
Homo sapiens	Mu opioid receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Mu opioid receptor	IC50	nan	None	None
Homo sapiens	Mu opioid receptor	Ki	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M1	IC50	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M1	Ki	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M2	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M2	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M2	IC50	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M2	Ki	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M3	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M3	IC50	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M3	Ki	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M4	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M4	IC50	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M4	Ki	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M5	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Muscarinic acetylcholine receptor M5	IC50	nan	None	None
Homo sapiens	Muscarinic acetylcholine receptor M5	Ki	nan	None	None
Homo sapiens	NCI/ADR-RES	GI50	100000.0	nM	None
Homo sapiens	NCI-H226	GI50	100000.0	nM	None
Homo sapiens	NCI-H23	GI50	100000.0	nM	None
Homo sapiens	NCI-H322M	GI50	100000.0	nM	None
Homo sapiens	NCI-H460	GI50	100000.0	nM	None
Homo sapiens	NCI-H522	GI50	100000.0	nM	None
Homo sapiens	Neurokinin 1 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Neurokinin 1 receptor	IC50	nan	None	None
Homo sapiens	Neurokinin 1 receptor	Ki	nan	None	None
Homo sapiens	Neurokinin 2 receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Neurokinin 2 receptor	IC50	nan	None	None
Homo sapiens	Neurokinin 2 receptor	Ki	nan	None	None
Homo sapiens	Neuronal acetylcholine receptor protein alpha-4 subunit	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Neuropeptide Y receptor type 1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Neuropeptide Y receptor type 1	IC50	nan	None	None
Homo sapiens	Neuropeptide Y receptor type 1	Ki	nan	None	None
Homo sapiens	Neuropeptide Y receptor type 2	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Neuropeptide Y receptor type 2	IC50	nan	None	None
Homo sapiens	Neuropeptide Y receptor type 2	Ki	nan	None	None
Homo sapiens	Neurotensin receptor 1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Norepinephrine transporter	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Norepinephrine transporter	IC50	nan	None	None
Homo sapiens	Norepinephrine transporter	Ki	nan	None	None
Homo sapiens	OVCAR-3	GI50	100000.0	nM	None
Homo sapiens	OVCAR-4	GI50	100000.0	nM	None
Homo sapiens	OVCAR-5	GI50	100000.0	nM	None
Homo sapiens	OVCAR-8	GI50	100000.0	nM	None
Homo sapiens	Parathyroid hormone receptor	Potency	8.9	nM	None
Homo sapiens	PBMC	Activity	48.0	%	10.1128/aac.01543-06
Homo sapiens	PBMC	Activity	83.0	%	10.1128/aac.01543-06
Homo sapiens	PBMC	Activity	92.0	%	10.1128/aac.01543-06
Homo sapiens	PBMC	Activity	nan	None	10.1128/aac.01543-06
Homo sapiens	PBMC	CC50	52.97	ug.mL-1	10.1016/j.bmc.2011.01.024
Homo sapiens	PBMC	CC50	10000.0	nM	10.1021/jm0309708
Homo sapiens	PBMC	CC50	13097.0	nM	10.1021/jm300492q
Homo sapiens	PBMC	CC50	100000.0	nM	10.1016/j.bmcl.2017.01.010
Homo sapiens	PBMC	CC50	100000.0	nM	10.1016/j.ejmech.2017.06.062
Homo sapiens	PBMC	CCID50	4000.0	uM	10.1016/j.bmc.2009.07.032
Homo sapiens	PBMC	Drug uptake	0.1	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	0.12	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	0.18	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	0.52	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	0.66	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	0.73	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	1.01	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	1.66	uM	10.1128/aac.01204-06
Homo sapiens	PBMC	Drug uptake	10.5	pmol	10.1128/aac.00831-06
Homo sapiens	PBMC	Drug uptake	11.1	pmol	10.1128/aac.00831-06
Homo sapiens	PBMC	EC50	11.6	nM	10.1021/jm0309708
Homo sapiens	PBMC	EC50	27.0	nM	10.1021/jm050096d
Homo sapiens	PBMC	EC50	100000.0	nM	10.1021/jm050096d
Homo sapiens	PBMC	EC90	0.08	uM	10.1021/jm0303148
Homo sapiens	PBMC	EC90	0.25	uM	10.1021/jm050096d
Homo sapiens	PBMC	EC90	100.0	uM	10.1021/jm050096d
Homo sapiens	PBMC	EC90	535.0	uM	10.1021/jm0303148
Homo sapiens	PBMC	Fold increase	100.0	None	10.1021/jm050096d
Homo sapiens	PBMC	Fold increase	3700.0	None	10.1021/jm050096d
Homo sapiens	PBMC	IC50	100000.0	nM	10.1016/j.ejmech.2011.05.051
Homo sapiens	PBMC	TC50	500.0	nM	10.1016/j.bmcl.2012.07.037
Homo sapiens	PC-3	GI50	1000000.0	nM	None
Homo sapiens	Phosphodiesterase 3A	AC50	26358.5	nM	10.1038/s41467-023-40064-9
Homo sapiens	Phosphodiesterase 3A	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Phosphodiesterase 4A	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Phosphodiesterase 4D	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Phosphodiesterase 5A	IC50	nan	None	None
Homo sapiens	Phosphodiesterase 5A	Ki	nan	None	None
Homo sapiens	Phosphodiesterase 6A	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Platelet activating factor receptor	IC50	nan	None	None
Homo sapiens	Platelet activating factor receptor	Ki	nan	None	None
Homo sapiens	Pregnane X receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Prelamin-A/C	Potency	35481.3	nM	None
Homo sapiens	Progesterone receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Protein kinase C alpha	IC50	nan	None	None
Homo sapiens	Protein kinase C alpha	Ki	nan	None	None
Homo sapiens	Receptor protein-tyrosine kinase erbB-2	IC50	nan	None	None
Homo sapiens	Receptor protein-tyrosine kinase erbB-2	Ki	nan	None	None
Homo sapiens	RPMI-8226	GI50	100000.0	nM	None
Homo sapiens	RXF 393	GI50	100000.0	nM	None
Homo sapiens	Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform	IC50	nan	None	None
Homo sapiens	Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform	Ki	nan	None	None
Homo sapiens	Serotonin 1a (5-HT1a) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 1a (5-HT1a) receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2a (5-HT2a) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2a (5-HT2a) receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2a (5-HT2a) receptor	IC50	nan	None	None
Homo sapiens	Serotonin 2a (5-HT2a) receptor	Ki	nan	None	None
Homo sapiens	Serotonin 2b (5-HT2b) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2b (5-HT2b) receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2b (5-HT2b) receptor	IC50	nan	None	None
Homo sapiens	Serotonin 2b (5-HT2b) receptor	Ki	nan	None	None
Homo sapiens	Serotonin 2c (5-HT2c) receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 2c (5-HT2c) receptor	IC50	nan	None	None
Homo sapiens	Serotonin 2c (5-HT2c) receptor	Ki	nan	None	None
Homo sapiens	Serotonin 3a (5-HT3a) receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 5a (5-HT5a) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 6 (5-HT6) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin 6 (5-HT6) receptor	IC50	nan	None	None
Homo sapiens	Serotonin 6 (5-HT6) receptor	Ki	nan	None	None
Homo sapiens	Serotonin 7 (5-HT7) receptor	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin transporter	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Serotonin transporter	IC50	nan	None	None
Homo sapiens	Serotonin transporter	Ki	nan	None	None
Homo sapiens	Serum albumin	Kd	44000.0	nM	10.1016/j.bmcl.2015.05.099
Homo sapiens	SF-268	GI50	100000.0	nM	None
Homo sapiens	SF-295	GI50	91833.26	nM	None
Homo sapiens	SF-539	GI50	100000.0	nM	None
Homo sapiens	Sigma opioid receptor	IC50	nan	None	None
Homo sapiens	Sigma opioid receptor	Ki	nan	None	None
Homo sapiens	SK-MEL-2	GI50	100000.0	nM	None
Homo sapiens	SK-MEL-28	GI50	100000.0	nM	None
Homo sapiens	SK-MEL-5	GI50	100000.0	nM	None
Homo sapiens	SK-OV-3	GI50	100000.0	nM	None
Homo sapiens	SN12C	GI50	100000.0	nM	None
Homo sapiens	SN12K1	GI50	60394.86	nM	None
Homo sapiens	SNB-19	GI50	100000.0	nM	None
Homo sapiens	SNB-75	GI50	100000.0	nM	None
Homo sapiens	SNB-78	GI50	100000.0	nM	None
Homo sapiens	Sodium channel protein type V alpha subunit	AC50	50000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Solute carrier family 22 member 6	Activity	nan	None	10.1038/nrd3028
Homo sapiens	SR	GI50	677641.51	nM	None
Homo sapiens	SUP-T1	CC50	nan	None	10.1021/acs.jnatprod.6b00878
Homo sapiens	SW-620	GI50	100000.0	nM	None
Homo sapiens	T47D	GI50	1000000.0	nM	None
Homo sapiens	Thrombin	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Thromboxane A2 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Thromboxane-A synthase	IC50	nan	None	None
Homo sapiens	Thromboxane-A synthase	Ki	nan	None	None
Homo sapiens	TK-10	GI50	1000000.0	nM	None
Homo sapiens	Type-1 angiotensin II receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Tyrosine-protein kinase FYN	IC50	nan	None	None
Homo sapiens	Tyrosine-protein kinase FYN	Ki	nan	None	None
Homo sapiens	Tyrosine-protein kinase LCK	IC50	nan	None	None
Homo sapiens	Tyrosine-protein kinase LCK	Ki	nan	None	None
Homo sapiens	Tyrosyl-DNA phosphodiesterase 1	Potency	14818.0	nM	None
Homo sapiens	Tyrosyl-DNA phosphodiesterase 1	Potency	16626.1	nM	None
Homo sapiens	U-251	GI50	100000.0	nM	None
Homo sapiens	UACC-257	GI50	75683.29	nM	None
Homo sapiens	UACC-62	GI50	100000.0	nM	None
Homo sapiens	UO-31	GI50	100000.0	nM	None
Homo sapiens	Vascular endothelial growth factor receptor 1	IC50	nan	None	None
Homo sapiens	Vascular endothelial growth factor receptor 1	Ki	nan	None	None
Homo sapiens	Vascular endothelial growth factor receptor 2	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Vasoactive intestinal polypeptide receptor 1	IC50	nan	None	None
Homo sapiens	Vasoactive intestinal polypeptide receptor 1	Ki	nan	None	None
Homo sapiens	Vasopressin V1a receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Vasopressin V1a receptor	IC50	nan	None	None
Homo sapiens	Vasopressin V1a receptor	Ki	nan	None	None
Homo sapiens	Vasopressin V2 receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	Voltage-gated L-type calcium channel	IC50	54200.0	nM	10.1038/srep02100
Homo sapiens	Voltage-gated L-type calcium channel alpha-1C subunit	AC50	50000.0	nM	10.1038/s41467-023-40064-9
Homo sapiens	XF498	GI50	100000.0	nM	None
Human adenovirus 2	Human adenovirus 2	IC50	100000.0	nM	10.1016/j.bmc.2008.11.075
Human alphaherpesvirus 1	Human alphaherpesvirus 1	EC50	nan	nM	10.1021/jm034265a
Human alphaherpesvirus 1	Human alphaherpesvirus 1	IC50	2200.0	nM	10.1021/jm020036x
Human gammaherpesvirus 4	Human gammaherpesvirus 4	EC50	400.0	nM	10.1021/jm034265a
Human immunodeficiency virus	Human immunodeficiency virus	EC50	1.8	nM	10.1021/jm00054a001
Human immunodeficiency virus	Human immunodeficiency virus	EC50	60.0	nM	10.1021/jm00054a001
Human immunodeficiency virus	Human immunodeficiency virus	EC50	210.0	nM	10.1021/jm00054a001
Human immunodeficiency virus	Human immunodeficiency virus	EC50	2000.0	nM	10.1016/s0960-894x(98)00277-7
Human immunodeficiency virus	Human immunodeficiency virus	EC50	10100.0	nM	10.1021/jm00054a001
Human immunodeficiency virus	Human immunodeficiency virus	EC50	nan	nM	10.1021/jm034265a
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Activity	nan	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1.8	nM	10.1021/jm00070a006
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2.0	nM	10.1016/j.ejmech.2022.114554
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	12.0	nM	10.1016/j.ejmech.2019.111864
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	18.0	nM	10.1016/j.ejmech.2019.111864
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	19.0	nM	10.1016/j.ejmech.2019.111864
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	21.0	nM	10.1016/j.ejmech.2019.111864
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	26.0	nM	10.1128/aac.01543-06
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	28.0	nM	10.1016/j.ejmech.2019.111864
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	40.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	41.0	nM	10.1021/jm040027j
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	47.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	60.0	nM	10.1021/np0003995
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	63.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	67.0	nM	10.1016/j.ejmech.2011.05.051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	70.0	nM	10.1021/jm990113x
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	71.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	81.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	86.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	90.0	nM	10.1016/j.bmcl.2012.07.037
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	99.0	nM	10.1016/j.ejmech.2013.09.047
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	105.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	171.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	182.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	183.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	200.0	nM	10.1016/j.bmcl.2012.07.037
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	202.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	210.0	nM	10.1016/j.ejmech.2021.113680
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	210.0	nM	10.1021/jm00070a006
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	219.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	300.0	nM	10.1021/acs.jmedchem.0c00940
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	300.0	nM	10.1021/acs.jnatprod.9b00022
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	372.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	462.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	470.0	nM	10.1128/aac.00686-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	554.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	650.0	nM	10.1128/aac.00686-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	667.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	800.0	nM	10.1128/aac.01209-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	850.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	880.0	nM	10.1128/aac.01004-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	890.0	nM	10.1016/j.bmcl.2015.01.058
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	927.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	969.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1080.0	nM	10.1128/aac.00686-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1140.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1151.6	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1259.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1460.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1620.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1683.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1800.0	nM	10.1016/j.bmc.2013.09.009
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1920.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	1985.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2000.0	nM	10.1021/acs.jmedchem.1c00790
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2100.0	nM	10.1128/aac.00686-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2130.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2170.0	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2200.0	nM	10.1016/j.ejmech.2015.02.022
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2220.0	nM	10.1016/j.ejmech.2014.09.054
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2239.0	nM	10.1016/j.ejmech.2015.01.042
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2240.0	nM	10.1016/j.bmc.2014.11.032
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2360.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2442.0	nM	10.1016/j.bmc.2014.03.020
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2445.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2470.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2530.0	nM	10.1021/acs.jmedchem.2c00667
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2540.0	nM	10.1016/j.bmc.2017.06.022
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2690.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2710.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2740.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2770.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	2791.7	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3070.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3140.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3140.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3200.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3200.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3247.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3250.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3360.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3400.0	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3540.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3580.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3700.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3700.0	nM	10.1128/aac.01004-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3750.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3880.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3900.0	nM	10.1021/acs.jnatprod.5b00116
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	3900.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4060.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4240.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4400.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4450.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4480.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4540.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4560.0	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4570.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4680.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4780.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	4790.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5000.0	nM	10.1016/j.ejmech.2022.114563
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5020.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5060.0	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5234.5	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5430.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5540.0	nM	10.1016/j.ejmech.2019.111619
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5760.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	5900.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6000.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6010.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6100.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6110.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6410.0	nM	10.1021/acs.jmedchem.8b01729
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6640.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	6830.0	nM	10.1016/j.ejmech.2020.113051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	7000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	7160.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	7300.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	7600.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	7770.0	nM	10.1016/j.bmc.2018.12.039
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	8100.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	8266.1	nM	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	8350.0	nM	10.1016/j.ejmech.2020.112811
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	8490.0	nM	10.1016/j.ejmech.2021.113868
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	10000.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	10300.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	11000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	11300.0	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	11400.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	12800.0	nM	10.1016/j.bmc.2018.12.039
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	14000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	17100.0	nM	10.1016/j.bmc.2018.12.039
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	20000.0	nM	10.1021/np200855d
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	22000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	32700.0	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	32700.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	43000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	46000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	50000.0	nM	10.1021/jm040027j
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	60000.0	nM	10.1128/aac.00686-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	68000.0	nM	10.1128/aac.01204-06
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	71000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	80300.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	90000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	100000.0	nM	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	300000.0	nM	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	300000.0	nM	10.1128/aac.01703-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1016/j.bmc.2014.03.020
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1016/j.bmc.2014.11.032
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1016/j.ejmech.2014.09.054
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1016/j.ejmech.2015.01.042
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1016/j.ejmech.2015.02.022
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1021/acs.jmedchem.8b01729
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC50	nan	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC90	0.12	uM	10.1128/aac.01543-06
Human immunodeficiency virus 1	Human immunodeficiency virus 1	EC90	0.32	uM	10.1016/j.ejmech.2011.05.051
Human immunodeficiency virus 1	Human immunodeficiency virus 1	ED50	0.36	uM	10.1021/np030469i
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.4	None	10.1128/aac.01593-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.7	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.7	None	10.1128/aac.01593-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.8	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.8	None	10.1128/aac.01593-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.83	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.87	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.9	None	10.1128/aac.01593-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	0.92	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.0	None	10.1128/aac.00687-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.06	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.07	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.13	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.15	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.31	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.37	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.6	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	1.9	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	2.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	2.1	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	2.4	None	10.1128/aac.00687-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	2.7	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	2.9	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	3.7	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	5.1	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	5.96	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	12.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	19.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	24.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	71.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	80.0	None	10.1128/aac.00068-10
Human immunodeficiency virus 1	Human immunodeficiency virus 1	FC	103.0	None	10.1128/aac.01559-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	0.043	ug.mL-1	10.1021/jm00010a010
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	0.19	ug.mL-1	10.1016/j.bmc.2011.01.024
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	0.58	ug.mL-1	10.1016/j.ejmech.2016.04.019
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	21.8	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	21.8	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	30.0	nM	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	87.3	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	87.3	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	92.1	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	92.1	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	100.0	nM	10.1021/acs.jnatprod.6b00878
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	171.0	nM	10.1021/acs.jmedchem.8b00141
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	200.0	nM	10.1016/j.bmc.2009.07.032
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	510.0	nM	10.1016/j.bmcl.2018.04.049
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	600.0	nM	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	780.0	nM	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	812.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	870.0	nM	10.1021/acs.jmedchem.1c00790
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	1200.0	nM	10.1021/np030469i
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	1200.0	nM	10.1021/np400779v
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	3890.0	nM	10.1016/j.ejmech.2014.05.059
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	3900.0	nM	10.1021/np500271u
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	10000.0	nM	10.1016/j.bmcl.2018.04.049
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	13097.0	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	13097.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	60000.0	nM	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	60500.0	nM	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	100000.0	nM	10.1021/jm00054a001
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	100000.0	nM	10.1021/jm00070a006
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	nan	None	10.1016/j.bmcl.2018.04.049
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	nan	None	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	282.9	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	282.9	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	305.6	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	305.6	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	9622.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	13097.0	nM	10.1021/jm201551m
Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC90	13097.0	nM	10.1021/jm300492q
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Inhibition	37.0	%	10.1016/j.bmcl.2011.04.006
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Inhibition	45.0	%	10.1128/aac.01204-06
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Inhibition	100.0	%	10.1016/j.bmc.2011.01.024
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Inhibition	nan	%	10.1016/j.bmc.2016.04.009
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Inhibition	nan	%	10.1021/acs.jnatprod.6b00878
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.22	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.41	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.533	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.65	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.87	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	0.97	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.0	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.2	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.3	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.4	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.58	None	10.1016/j.bmc.2021.116531
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	1.8	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	2.0	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	2.5	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	2.7	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	2.7	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	4.0	None	10.1128/aac.01004-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	4.5	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	5.5	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	5.7	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	7.0	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	8.8	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	9.0	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	11.3	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	250.0	None	10.1128/aac.01313-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	272.0	None	10.1128/aac.00984-08
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	300.0	None	10.1021/np200855d
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio EC50	nan	None	10.1016/j.ejmech.2015.01.042
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	4.0	None	10.1128/aac.00687-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	19.6	None	10.1016/j.bmcl.2018.04.049
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	29.3	None	10.1128/aac.00687-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	75.0	None	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	77.0	None	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	84.5	None	10.1128/aac.00687-07
Human immunodeficiency virus 1	Human immunodeficiency virus 1	Ratio IC50	nan	None	10.1128/aac.00392-09
Human immunodeficiency virus 1	Human immunodeficiency virus 1	TIME	26.75	hr	10.1021/acs.jmedchem.0c00940
Human immunodeficiency virus 1	Human immunodeficiency virus 1	TIME	42.7	hr	10.1021/acs.jmedchem.0c00940
Human immunodeficiency virus 1	Human immunodeficiency virus type 1 protease	FI	1200.0	None	10.1016/s0960-894x(03)00330-5
Human immunodeficiency virus 1	Human immunodeficiency virus type 1 reverse transcriptase	EC50	42.0	nM	10.1016/s0960-894x(03)00330-5
Human immunodeficiency virus 1	Human immunodeficiency virus type 1 reverse transcriptase	EC50	50000.0	nM	10.1016/s0960-894x(03)00330-5
Human immunodeficiency virus 1	Human immunodeficiency virus type 1 reverse transcriptase	IC50	nan	None	10.1016/j.ejmech.2022.114563
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	180.0	nM	10.1016/j.ejmech.2013.09.047
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	2000.0	nM	10.1128/aac.01004-07
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	3560.0	nM	10.1016/j.bmcl.2015.01.058
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	5900.0	nM	10.1016/j.bmc.2013.09.009
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	7200.0	nM	10.1016/j.bmc.2014.03.020
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	8790.0	nM	10.1016/j.bmc.2014.11.032
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	8810.0	nM	10.1016/j.ejmech.2014.09.054
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	9900.0	nM	10.1021/acs.jmedchem.2c00667
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	15500.0	nM	10.1021/acs.jnatprod.5b00116
Human immunodeficiency virus 2	Human immunodeficiency virus 2	EC50	nan	None	10.1016/j.ejmech.2022.114563
Human immunodeficiency virus 2	Human immunodeficiency virus 2	IC50	15500.0	nM	10.1021/np500271u
Human immunodeficiency virus 2	Human immunodeficiency virus 2	IC50	15530.0	nM	10.1016/j.ejmech.2014.05.059
Human immunodeficiency virus type 1 group M subtype B (isolate NY5)(HIV-1)	Virion infectivity factor	Inhibition	nan	%	10.1021/acs.jmedchem.0c00940
Human T-cell leukemia virus type I	Human T-cell leukemia virus type I	IC50	14.24	ug.mL-1	10.1016/j.bmc.2011.01.024
Human T-cell leukemia virus type I	Human T-cell leukemia virus type I	Inhibition	100.0	%	10.1016/j.bmc.2011.01.024
Klebsiella pneumoniae	Klebsiella pneumoniae	Inhibition	20.65	%	10.6019/CHEMBL4513141
Marmota monax	Marmota monax	Activity	nan	None	10.1128/aac.00654-08
Mus musculus	Heat shock factor protein 1	EC50	287.0	nM	None
Mus musculus	L1210	IC50	250000.0	nM	10.1016/j.ejmech.2013.09.047
Mus musculus	Mus musculus	Activity	1.2	%	10.1016/j.bmcl.2012.12.097
Mus musculus	Mus musculus	Activity	16.7	%	10.1016/j.bmcl.2012.12.097
Mus musculus	Mus musculus	Activity	19.3	%	10.1016/j.bmcl.2012.12.097
Mus musculus	Mus musculus	Activity	34.1	%	10.1016/j.bmcl.2012.12.097
Mus musculus	Mus musculus	Activity	nan	None	10.1016/j.bmcl.2012.12.097
Mus musculus	Nitric oxide synthase, inducible	IC50	nan	None	None
Mus musculus	Nitric oxide synthase, inducible	Ki	nan	None	None
Mus musculus	P388	GI50	100000.0	nM	None
Mus musculus	P388/ADR	GI50	77446.18	nM	None
Mycobacterium avium	Mycobacterium avium	Inhibition	0.0	%	10.1021/jm070391t
Mycobacterium tuberculosis	Mycobacterium tuberculosis	Inhibition	0.0	%	10.1021/jm070391t
Oryctolagus cuniculus	Angiotensin-converting enzyme	IC50	nan	None	None
Oryctolagus cuniculus	Angiotensin-converting enzyme	Ki	nan	None	None
Oryctolagus cuniculus	Arachidonate 15-lipoxygenase	IC50	nan	None	None
Oryctolagus cuniculus	Arachidonate 15-lipoxygenase	Ki	nan	None	None
Oryctolagus cuniculus	Oryctolagus cuniculus	EC50	nan	nM	10.1021/jm034265a
Plasmodium falciparum	Plasmodium falciparum	Potency	15101.4	nM	None
Porcine endogenous retrovirus	Porcine endogenous retrovirus	EC50	100000.0	nM	10.1128/aac.00212-07
Pseudomonas aeruginosa	Pseudomonas aeruginosa	Inhibition	10.87	%	10.6019/CHEMBL4513141
Rattus norvegicus	Aldose reductase	IC50	nan	None	None
Rattus norvegicus	Aldose reductase	Ki	nan	None	None
Rattus norvegicus	Alpha-1a adrenergic receptor	IC50	nan	None	None
Rattus norvegicus	Alpha-1a adrenergic receptor	Ki	nan	None	None
Rattus norvegicus	Alpha-1b adrenergic receptor	IC50	nan	None	None
Rattus norvegicus	Alpha-1b adrenergic receptor	Ki	nan	None	None
Rattus norvegicus	Androgen Receptor	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Rattus norvegicus	Androgen Receptor	IC50	nan	None	None
Rattus norvegicus	Androgen Receptor	Ki	nan	None	None
Rattus norvegicus	Cyclooxygenase-1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Rattus norvegicus	GABA receptor alpha-1 subunit	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Rattus norvegicus	Glutamate (NMDA) receptor subunit zeta 1	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Rattus norvegicus	Glycine receptor	IC50	nan	None	None
Rattus norvegicus	Glycine receptor	Ki	nan	None	None
Rattus norvegicus	Insulin receptor	IC50	nan	None	None
Rattus norvegicus	Insulin receptor	Ki	nan	None	None
Rattus norvegicus	Nitric-oxide synthase, brain	IC50	nan	None	None
Rattus norvegicus	Nitric-oxide synthase, brain	Ki	nan	None	None
Rattus norvegicus	Plasma	Fu	0.94	None	10.1021/jm901371v
Rattus norvegicus	Plasma	logFu	0.82	None	10.1016/j.ejmech.2009.06.004
Rattus norvegicus	Rattus norvegicus	ALB	39000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALB	40000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALB	40700.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALB	40800.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALB	41000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALB	42700.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	303.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	359.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	368.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	373.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	390.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALP	395.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	45.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	45.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	48.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	50.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	50.5	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	ALT	51.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	80.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	80.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	82.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	84.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	85.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	AST	87.5	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BASO	0.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BASOLE	0.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BILI	1.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BILI	1.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BILI	2.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BILI	2.2	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	106.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	123.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	128.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	150.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	158.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	BUN	166.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	98.33	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	99.67	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	100.33	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	100.83	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	102.0	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHLORIDE	102.33	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	623.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	633.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	700.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	780.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	786.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CHOL	796.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	237.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	248.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	295.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	337.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	391.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CK	585.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CL	46.5	mL.min-1.kg-1	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	Cmax	1195.15	nM	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	CO2	24330000.0	nM	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CO2	27000000.0	nM	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CO2	31330000.0	nM	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CO2	32830000.0	nM	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CO2	34330000.0	nM	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CREAT	1.6	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CREAT	1.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CREAT	2.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	CREAT	2.2	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOS	0.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOS	14.5	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOS	40.67	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOS	61.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOSLE	0.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOSLE	0.17	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	EOSLE	0.33	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	F	18.7	%	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	GLUC	1246.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	GLUC	1356.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	GLUC	1410.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	GLUC	1520.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	GLUC	1626.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HCT	34.33	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HCT	34.5	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HCT	34.72	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HCT	34.73	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HCT	36.2	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	133300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	134000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	134700.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	135300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	136000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	HGB	139300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LDH	141.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LDH	167.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LDH	171.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LDH	239.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LDH	297.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LIPASE	8.33	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LIPASE	9.5	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LIPASE	9.67	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LIPASE	10.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LIPASE	11.0	U.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	6530.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	7596.17	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	8482.5	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	11136.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	11276.67	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYM	14479.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	88.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	89.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	90.17	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	92.17	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	92.33	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	LYMLE	94.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCH	24.3	pg	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCH	24.43	pg	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCH	24.5	pg	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCH	24.57	pg	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	385000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	386300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	388200.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	390300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	392000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCHC	394000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	61.97	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	62.3	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	62.8	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	62.88	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	63.3	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MCV	63.7	fL	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	63.83	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	69.67	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	81.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	98.67	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	119.67	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONO	224.33	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONOLE	0.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONOLE	1.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	MONOLE	1.33	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	4.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	6.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	7.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	9.0	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	9.17	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTLE	9.67	%	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	470.33	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	503.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	638.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	842.33	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	887.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	NEUTSG	1569.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	107.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	109.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	111.8	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	114.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	118.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PHOS	119.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1022830.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1079330.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1141000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1155330.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1204330.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PLAT	1274000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	5.48	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	6.04	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	6.07	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	6.19	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	6.25	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	POTASSIUM	6.42	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	57300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	58000.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	60800.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	61200.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	61300.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	PROT	63700.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBC	5470000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBC	5490000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBC	5540000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBC	5570000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBC	5680000.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBCNUC	0.0	/100WBC	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBCNUC	0.33	/100WBC	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	RBCNUC	0.67	/100WBC	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	143.47	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	143.87	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	144.2	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	144.47	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	144.87	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	SODIUM	145.35	mEq.L-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	T1/2	1.23	hr	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	Tissue Severity Score	nan	None	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	Tmax	5.0	hr	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	URATE	6.0	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	URATE	6.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	URATE	6.5	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	URATE	8.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	URATE	15.3	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	URATE	15.7	ug.mL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	Vd	4.77	L.kg-1	10.1021/jm5012963
Rattus norvegicus	Rattus norvegicus	WBC	7270.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	WBC	8180.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	WBC	9430.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	WBC	11770.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	WBC	12200.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Rattus norvegicus	WBC	16330.0	cells.uL-1	10.6019/CHEMBL3885881
Rattus norvegicus	Serotonin 1a (5-HT1a) receptor	IC50	nan	None	None
Rattus norvegicus	Serotonin 1a (5-HT1a) receptor	Ki	nan	None	None
Rattus norvegicus	Serotonin 1b (5-HT1b) receptor	IC50	nan	None	None
Rattus norvegicus	Serotonin 1b (5-HT1b) receptor	Ki	nan	None	None
Rattus norvegicus	Solute carrier family 22 member 6	Activity	nan	None	None
Rattus norvegicus	Voltage-gated L-type calcium channel alpha-1C subunit	AC50	30000.0	nM	10.1038/s41467-023-40064-9
Rattus norvegicus	Voltage-gated N-type calcium channel alpha-1B subunit	AC50	10000.0	nM	10.1038/s41467-023-40064-9
Severe acute respiratory syndrome coronavirus 2	Replicase polyprotein 1ab	Inhibition	12.92	%	10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2	Replicase polyprotein 1ab	Inhibition	22.44	%	10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	IC50	50100.0	nM	10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	IC50	50118.72	nM	10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	Inhibition	-1.99	%	10.21203/rs.3.rs-23951/v1
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	Inhibition	0.03	%	10.6019/CHEMBL4495565
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	Inhibition	0.04	%	10.6019/CHEMBL4495565
Severe acute respiratory syndrome coronavirus 2	SARS-CoV-2	Inhibition index	0.1154	None	10.1101/2020.04.03.023846
Staphylococcus aureus	Staphylococcus aureus	Inhibition	9.88	%	10.6019/CHEMBL4513141
Vaccinia virus	Vaccinia virus	IC50	436000.0	nM	10.1016/j.bmc.2008.11.075
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	1.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	2.5	None	10.1128/aac.00325-07
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	4.4	log10ng/ml	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	4.6	log10ng/ml	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	4.7	log10ng/ml	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	5.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	5.2	log10ng/ml	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	33.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	36.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	39.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	39.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	46.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	47.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	48.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	59.0	%	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	413.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	982.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	1063.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	1133.0	pg	10.1128/aac.00654-08
Woodchuck hepatitis virus	Woodchuck hepatitis virus	Activity	nan	None	10.1128/aac.00654-08
None	ADMET	Activity	nan	None	10.1016/j.ejmech.2011.05.051
None	ADMET	Activity	nan	None	10.1021/acsmedchemlett.9b00184
None	ADMET	Activity	nan	None	10.1021/np030469i
None	ADMET	Activity	nan	None	10.1128/aac.00434-08
None	ADMET	AUC	0.0298	ng.hr.mL-1	10.1021/acs.jmedchem.0c00940
None	ADMET	AUC	90523.31	ng.hr.mL-1	10.1021/acs.jmedchem.0c00940
None	ADMET	CC50	5.94	ug.mL-1	10.1016/j.bmc.2011.01.024
None	ADMET	CC50	200.0	ug.mL-1	10.1016/j.bmcl.2010.08.120
None	ADMET	CC50	5000.0	nM	10.1016/j.bmc.2010.05.076
None	ADMET	CC50	10000.0	nM	10.1016/s0960-894x(03)00496-7
None	ADMET	CC50	87240.0	nM	10.1016/j.bmc.2021.116531
None	ADMET	CC50	100000.0	nM	10.1016/S0960-894X(97)00178-9
None	ADMET	CC50	100000.0	nM	10.1073/pnas.0609883104
None	ADMET	CC50	100000.0	nM	10.1128/aac.00212-07
None	ADMET	CC50	100000.0	nM	10.1128/aac.01241-07
None	ADMET	CC50	391210.0	nM	10.1016/j.bmcl.2013.01.046
None	ADMET	CC50	873000.0	nM	10.1021/jm100803c
None	ADMET	CC50	1000000.0	nM	10.1016/j.bmcl.2012.12.097
None	ADMET	CC50	1000000.0	nM	10.1016/j.ejmech.2007.03.005
None	ADMET	CC50	1000000.0	nM	10.1128/aac.01440-06
None	ADMET	CC50	1174000.0	nM	10.1016/j.bmc.2011.04.004
None	ADMET	CC50	2183100.0	nM	10.1016/j.bmcl.2010.10.099
None	ADMET	CC50	2400000.0	nM	10.1021/np100745z
None	ADMET	CC50	2675000.0	nM	10.1021/jm058200e
None	ADMET	CC50	30000000.0	nM	10.1016/j.bmcl.2008.05.065
None	ADMET	CC50	30000000.0	nM	10.1016/j.ejmech.2010.11.019
None	ADMET	CC50	30000000.0	nM	10.1021/np070479+
None	ADMET	CC50	31000000.0	nM	10.1016/j.bmcl.2009.02.122
None	ADMET	CC50	31180000.0	nM	10.1016/j.bmcl.2013.01.118
None	ADMET	CC50	33250000.0	nM	10.1021/np200256b
None	ADMET	CC50	35000000.0	nM	10.1016/j.bmcl.2009.10.006
None	ADMET	CC50	nan	None	10.1073/pnas.0609883104
None	ADMET	CL	4.8	mL.min-1.kg-1	10.1124/dmd.108.020479
None	ADMET	CL	13.0	mL.min-1.kg-1	10.1002/jps.20373
None	ADMET	CL	20.0	mL.min-1.kg-1	10.1002/jps.20373
None	ADMET	CL	22.0	mL.min-1.kg-1	10.1002/jps.20373
None	ADMET	CL	72.0	mL.min-1.kg-1	10.1002/jps.20373
None	ADMET	Cmax	0.03	nM	10.1021/acs.jmedchem.0c00940
None	ADMET	Cmax	93.57	nM	10.1021/acs.jmedchem.0c00940
None	ADMET	Cmax	31349.7	nM	10.1021/acs.jmedchem.0c00940
None	ADMET	Drug uptake	0.04	pmol	10.1128/aac.00831-06
None	ADMET	Drug uptake	0.09	pmol	10.1128/aac.00831-06
None	ADMET	Drug uptake	216.0	ng/ml	10.1128/aac.01523-08
None	ADMET	Drug uptake	271.0	ng/ml	10.1128/aac.01523-08
None	ADMET	Drug uptake	931.0	ng/ml	10.1128/aac.01523-08
None	ADMET	EC50	10.0	nM	10.1016/s0960-894x(03)00496-7
None	ADMET	EC50	35.0	nM	10.1021/jm0300274
None	ADMET	EC50	60.0	nM	10.1016/S0960-894X(01)81256-7
None	ADMET	EC50	70.0	nM	10.1021/jm9703698
None	ADMET	EC50	100000.0	nM	10.1021/jm0300274
None	ADMET	EC90	0.08	uM	10.1021/jm020246+
None	ADMET	EC90	100.0	uM	10.1021/jm0300274
None	ADMET	EC90	535.0	uM	10.1021/jm020246+
None	ADMET	F	86.0	%	10.1021/acs.jmedchem.1c00790
None	ADMET	F	86.0	%	10.1021/acs.jmedchem.8b01610
None	ADMET	IC50	2.0	nM	10.1016/S0960-894X(97)00178-9
None	ADMET	IC50	210.0	nM	10.1016/S0960-894X(97)00178-9
None	ADMET	IC50	100000.0	nM	10.1016/S0960-894X(01)81256-7
None	ADMET	IC50	100000.0	nM	10.1021/jm9703698
None	ADMET	IC50	100000.0	nM	10.1021/jm990113x
None	ADMET	IC50	2000000.0	nM	10.1021/jm801418v
None	ADMET	log10(%HIA +10)	1.987	None	10.1016/j.ejmech.2010.11.005
None	ADMET	MRT	4.4	hr	10.1124/dmd.108.020479
None	ADMET	Ratio	0.004	None	10.1128/aac.00831-06
None	ADMET	Ratio	0.009	None	10.1128/aac.00831-06
None	ADMET	Ratio	0.94	None	10.1128/aac.00434-08
None	ADMET	Ratio	1.0	None	10.1128/aac.01523-08
None	ADMET	Ratio	1.16	None	10.1128/aac.00434-08
None	ADMET	Ratio	14.2	None	10.1128/aac.01523-08
None	ADMET	Ratio	330.0	None	10.1021/acs.jmedchem.0c00940
None	ADMET	Ratio CC50/EC50	9.0	None	10.1021/acs.jmedchem.2c00667
None	ADMET	Ratio CC50/EC50	24.0	None	10.1021/acs.jmedchem.2c00667
None	ADMET	Ratio CC50/EC50	99.0	None	10.1016/j.bmcl.2023.129219
None	ADMET	Ratio CC50/EC50	200.0	None	10.1021/acs.jmedchem.6b01260
None	ADMET	Ratio CC50/EC50	254.0	None	10.1021/acs.jmedchem.6b01260
None	ADMET	Ratio CC50/EC50	267.86	None	10.1016/j.ejmech.2021.113780
None	ADMET	Ratio CC50/EC50	309.0	None	10.1016/j.bmc.2021.116531
None	ADMET	Ratio CC50/EC50	2907.0	None	10.1021/acs.jnatprod.9b00022
None	ADMET	Ratio CC50/IC50	1000.0	None	10.1016/j.ejmech.2022.114833
None	ADMET	Selectivity Index	15.0	None	10.1016/j.ejmech.2021.113868
None	ADMET	Selectivity Index	1000.0	None	10.1016/j.ejmech.2022.114159
None	ADMET	Selectivity Index	16214.0	None	10.1021/acs.jmedchem.2c00667
None	ADMET	Selectivity Index	57405.0	None	10.1021/acs.jmedchem.2c00667
None	ADMET	T1/2	5.0	hr	10.1021/acs.jmedchem.8b01610
None	ADMET	T1/2	9.1	hr	10.1124/dmd.108.020479
None	ADMET	T1/2	13.0	hr	10.1021/acs.jmedchem.1c00790
None	ADMET	T1/2	13.5	hr	10.1021/acs.jmedchem.0c00940
None	ADMET	TC50	5.75	umol	10.1016/j.bmcl.2014.07.032
None	ADMET	TC50	205.0	ug ml-1	10.1016/j.bmc.2014.12.064
None	ADMET	TC50	352.03	uM	10.1016/j.ejmech.2014.11.050
None	ADMET	TC50	961.5	ug ml-1	10.1016/j.ejmech.2010.01.032
None	ADMET	TC50	1000.0	ug ml-1	10.1016/j.bmc.2010.11.063
None	ADMET	TC50	2213.8	uM	10.1016/j.bmc.2008.05.029
None	ADMET	TC50	3427.82	uM	10.1016/j.bmc.2009.03.003
None	ADMET	TC50	3427.82	None	10.1016/j.bmc.2011.08.001
None	ADMET	TC90	0.82	umol	10.1016/j.bmcl.2014.07.032
None	ADMET	TI	2.5	None	10.1016/j.bmcl.2012.07.037
None	ADMET	TI	5.6	None	10.1016/j.bmcl.2012.07.037
None	ADMET	TI	975.61	None	10.1016/j.ejmech.2021.113680
None	ADMET	TI	1000.0	None	10.1021/jm00040a014
None	ADMET	Tmax	1.0	hr	10.1021/acs.jmedchem.0c00940
None	ADMET	Vdss	0.87	L.kg-1	10.1002/jps.20373
None	ADMET	Vdss	1.2	L.kg-1	10.1002/jps.20373
None	ADMET	Vdss	1.3	L.kg-1	10.1002/jps.20373
None	ADMET	Vdss	1.3	L.kg-1	10.1124/dmd.108.020479
None	ADMET	Vdss	1.8	mL/min/kg	10.1002/jps.20373
None	Hepatoblastoma cell line	CC50	1884000.0	nM	10.1021/jm980038a
None	Hepatoblastoma cell line	EC50	70.0	nM	10.1021/jm980038a
None	Hepatoblastoma cell line	EC90	0.209	uM	10.1021/jm980038a
None	Hepatoma cell line	EC50	10.0	nM	10.1016/0960-894X(95)00343-R
None	Hepatoma cell line	EC50	nan	nM	10.1016/0960-894X(95)00343-R
None	Hepatotoxicity	Alkaline Phosphatase Increase - Activity Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	Alkaline Phosphatase Increase - Index Value	2.1	None	10.2174/1570163043334794
None	Hepatotoxicity	Alkaline Phosphatase Increase - Number of Reports	4.0	None	10.2174/1570163043334794
None	Hepatotoxicity	Composite Activity - Active	2.0	None	10.2174/1570163043334794
None	Hepatotoxicity	Composite Activity - Marginal	0.0	None	10.2174/1570163043334794
None	Hepatotoxicity	Composite Activity - Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	GGT Increase - Activity Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	GGT Increase - Index Value	1.7	None	10.2174/1570163043334794
None	Hepatotoxicity	GGT Increase - Number of Reports	4.0	None	10.2174/1570163043334794
None	Hepatotoxicity	Hepatotoxicity	nan	None	10.1021/tx1000865
None	Hepatotoxicity	Hepatotoxicity	nan	None	10.1021/tx900326k
None	Hepatotoxicity	Hepatotoxicity	nan	None	10.1124/dmd.110.035113
None	Hepatotoxicity	HepSE_bilirubinemia	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_cholecystitis	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_cholelithiasis	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_cirrhosis	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_Combined Scores	3.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_elevated liver function tests	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_hepatic failure	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_hepatic necrosis	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_hepatitis	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_hepatomegaly	1.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_jaundice	1.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_liver disease	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_liver fatty	1.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	HepSE_liver function tests abnormal	0.0	None	10.1371/journal.pcbi.1002310
None	Hepatotoxicity	LDH Increase - Activity Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	LDH Increase - Index Value	2.1	None	10.2174/1570163043334794
None	Hepatotoxicity	LDH Increase - Number of Reports	4.0	None	10.2174/1570163043334794
None	Hepatotoxicity	LTKB_BD DILI severity score	8.0	None	10.1016/j.drudis.2011.05.007
None	Hepatotoxicity	SGOT Increase - Activity Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	SGOT Increase - Index Value	8.7	None	10.2174/1570163043334794
None	Hepatotoxicity	SGOT Increase - Number of Reports	4.0	None	10.2174/1570163043334794
None	Hepatotoxicity	SGPT Increase - Activity Score	nan	None	10.2174/1570163043334794
None	Hepatotoxicity	SGPT Increase - Index Value	9.0	None	10.2174/1570163043334794
None	Hepatotoxicity	SGPT Increase - Number of Reports	4.0	None	10.2174/1570163043334794
None	Molecular identity unknown	Activity	nan	None	10.1128/aac.01764-09
None	NON-PROTEIN TARGET	CC50	2000.0	nM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	CC50	87200.0	nM	10.1016/j.ejmech.2016.05.054
None	NON-PROTEIN TARGET	CC50	87200.0	nM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	CC50	87240.0	nM	10.1021/acs.jmedchem.6b00738
None	NON-PROTEIN TARGET	CC50	100000.0	nM	10.1016/j.ejmech.2016.07.048
None	NON-PROTEIN TARGET	CC50	1000000.0	nM	10.1021/jm020036x
None	NON-PROTEIN TARGET	CC50	2128000.0	nM	10.1016/j.bmcl.2011.01.109
None	NON-PROTEIN TARGET	CC50	2183100.0	nM	10.1016/j.bmc.2009.05.001
None	NON-PROTEIN TARGET	CC50	30000000.0	nM	10.1016/j.bmcl.2007.08.027
None	NON-PROTEIN TARGET	EC50	10.0	nM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	EC50	2220.0	nM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	EC50	2240.0	nM	10.1021/acs.jmedchem.6b00738
None	NON-PROTEIN TARGET	EC50	3100.0	nM	10.1016/j.ejmech.2016.05.054
None	NON-PROTEIN TARGET	EC50	8790.0	nM	10.1021/acs.jmedchem.6b00738
None	NON-PROTEIN TARGET	EC50	8810.0	nM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	EC50	nan	None	10.1016/j.ejmech.2016.05.054
None	NON-PROTEIN TARGET	EC90	2.0	uM	10.1021/acs.jmedchem.6b01260
None	NON-PROTEIN TARGET	Fu	0.94	None	10.1124/dmd.108.020479
None	NON-PROTEIN TARGET	Hepatotoxicity (acute)	12.5	%	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (animal toxicity known)	nan	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (benign tumour)	0.0	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (granulomatous hepatitis)	0.0	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (mechanism)	nan	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (moderate)	15.0	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (moderate)	44.0	%	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	Hepatotoxicity (time to onset)	nan	None	10.1016/s0399-8320(04)95062-2
None	NON-PROTEIN TARGET	IC50	100000.0	nM	10.1016/j.ejmech.2016.07.048
None	NON-PROTEIN TARGET	Potency	4.9	nM	None
None	NON-PROTEIN TARGET	Potency	6.9	nM	None
None	NON-PROTEIN TARGET	Potency	243.2	nM	None
None	NON-PROTEIN TARGET	Potency	343.5	nM	None
None	NON-PROTEIN TARGET	Selectivity Index	7.0	None	10.1016/j.ejmech.2014.01.046
None	No relevant target	LogP	-0.91	None	10.1016/j.bmc.2009.07.032
None	No relevant target	LogP	0.06	None	10.1021/jm0309708
None	No relevant target	P	0.92	None	10.1021/jm00040a014
None	No relevant target	pKa_B1	4.19	None	10.6019/CHEMBL3301361
None	No relevant target	solubility	nan	None	10.1016/j.ejmech.2016.05.054
None	Nucleic Acid	EC50	0.01	ug.mL-1	10.1016/s0960-894x(01)00589-3
None	Phospholipidosis	Phospholipidosis	nan	None	10.1080/15376510701857262
None	Unchecked	Ac50	12.59	uM	None
None	Unchecked	Ac50	14.13	uM	None
None	Unchecked	AC50	12589.3	nM	None
None	Unchecked	AC50	14130.0	nM	None
None	Unchecked	Activity	nan	None	10.1021/acs.jmedchem.0c00940
None	Unchecked	CC50	10000.0	nM	10.1016/j.bmcl.2016.07.005
None	Unchecked	CC50	80300.0	nM	10.1016/j.bmcl.2017.03.031
None	Unchecked	CC50	100000.0	nM	10.1016/j.bmc.2020.115952
None	Unchecked	CC50	100000.0	nM	10.1016/j.ejmech.2021.113780
None	Unchecked	CC50	100000.0	nM	10.1016/j.ejmech.2022.114833
None	Unchecked	EC50	11300.0	nM	10.1016/j.bmcl.2017.03.031
None	Unchecked	EC50	32700.0	nM	10.1016/j.bmcl.2017.03.031
None	Unchecked	EC50	nan	nM	10.1021/jm034265a
None	Unchecked	FC	0.17	None	10.1021/acs.jnatprod.6b00671
None	Unchecked	FC	0.21	None	10.1021/acs.jnatprod.6b00671
None	Unchecked	FI	2857.0	None	10.1021/jm0300274
None	Unchecked	FI	6688.0	None	10.1021/jm0303148
None	Unchecked	Hepatotoxicity (acute)	30.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (association with vascular disease)	0.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (choleostasis)	1.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (chronic liver disease)	1.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (cirrhosis)	0.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (comment)	nan	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (cytolytic)	26.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (malignant tumour)	0.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (severe hepatitis)	15.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (steatosis)	13.0	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	Hepatotoxicity (successful reintroduction)	nan	None	10.1016/s0399-8320(04)95062-2
None	Unchecked	IC50	50.0	ug.mL-1	10.1021/jm010410d
None	Unchecked	IC50	100.0	nM	10.1016/j.ejmech.2022.114159
None	Unchecked	IC50	100000.0	nM	10.1016/j.ejmech.2022.114159
None	Unchecked	IC50	107500.0	nM	10.1021/acs.jnatprod.6b00671
None	Unchecked	IC50	nan	None	None
None	Unchecked	ID50 ratio	100.0	None	10.1016/s0960-894x(98)00277-7
None	Unchecked	Inhibition	nan	%	10.1021/acs.jmedchem.0c00292
None	Unchecked	Kd	1510.0	nM	10.1021/acs.jmedchem.0c00940
None	Unchecked	Ki	nan	None	None
None	Unchecked	Ratio	7.1	None	10.1016/j.bmc.2008.05.029
None	Unchecked	Ratio	11200.0	None	10.1016/S0960-894X(97)00422-8
None	Unchecked	Ratio CC50/EC50	5.6	None	10.1016/j.bmcl.2015.01.058
None	Unchecked	Ratio CC50/EC50	5.6	None	10.1021/acs.jnatprod.5b00116
None	Unchecked	Ratio CC50/EC50	10.0	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio CC50/EC50	10.0	None	10.1021/acs.jmedchem.6b01260
None	Unchecked	Ratio CC50/EC50	13.0	None	10.1016/j.ejmech.2020.113051
None	Unchecked	Ratio CC50/EC50	14.0	None	10.1021/acs.jmedchem.8b01729
None	Unchecked	Ratio CC50/EC50	15.0	None	10.1016/j.bmc.2013.09.009
None	Unchecked	Ratio CC50/EC50	15.0	None	10.1016/j.ejmech.2020.113051
None	Unchecked	Ratio CC50/EC50	16.0	None	10.1016/j.ejmech.2019.111619
None	Unchecked	Ratio CC50/EC50	17.0	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio CC50/EC50	22.0	None	10.1016/j.ejmech.2019.111619
None	Unchecked	Ratio CC50/EC50	22.0	None	10.1021/acs.jnatprod.5b00116
None	Unchecked	Ratio CC50/EC50	28.0	None	10.1016/j.ejmech.2016.05.054
None	Unchecked	Ratio CC50/EC50	34.0	None	10.1016/j.bmc.2017.06.022
None	Unchecked	Ratio CC50/EC50	36.0	None	10.1016/j.bmc.2014.03.020
None	Unchecked	Ratio CC50/EC50	39.0	None	10.1016/j.bmc.2014.11.032
None	Unchecked	Ratio CC50/EC50	39.0	None	10.1016/j.ejmech.2014.09.054
None	Unchecked	Ratio CC50/EC50	39.0	None	10.1016/j.ejmech.2015.01.042
None	Unchecked	Ratio CC50/EC50	39.0	None	10.1021/acs.jmedchem.6b00738
None	Unchecked	Ratio CC50/EC50	39.0	None	10.1021/acs.jmedchem.6b01260
None	Unchecked	Ratio CC50/EC50	47.0	None	10.1016/j.bmc.2013.09.009
None	Unchecked	Ratio CC50/EC50	105.0	None	10.1021/acs.jmedchem.7b00416
None	Unchecked	Ratio CC50/EC50	225.0	None	10.1021/acs.jmedchem.7b00416
None	Unchecked	Ratio CC50/EC50	nan	None	10.1016/j.ejmech.2015.01.042
None	Unchecked	Ratio CC50/EC50	nan	None	10.1016/j.ejmech.2016.05.054
None	Unchecked	Ratio CC50/EC50	nan	None	10.1021/acs.jmedchem.8b01729
None	Unchecked	Ratio CC50/IC50	0.82	None	10.1016/j.bmcl.2009.02.122
None	Unchecked	Ratio CC50/IC50	1.0	None	10.1016/j.bmcl.2013.01.118
None	Unchecked	Ratio CC50/IC50	1.0	None	10.1016/j.ejmech.2017.12.042
None	Unchecked	Ratio CC50/IC50	1.0	None	10.1016/j.ejmech.2019.05.014
None	Unchecked	Ratio CC50/IC50	1.1	None	10.1016/j.bmcl.2013.01.118
None	Unchecked	Ratio CC50/IC50	1.1	None	10.1021/np200256b
None	Unchecked	Ratio CC50/IC50	1.16	None	10.1016/j.bmcl.2007.08.027
None	Unchecked	Ratio CC50/IC50	1.16	None	10.1021/np070479+
None	Unchecked	Ratio CC50/IC50	1.2	None	10.1016/j.bmcl.2008.05.065
None	Unchecked	Ratio CC50/IC50	1.28	None	10.1021/np200256b
None	Unchecked	Ratio CC50/IC50	1.6	None	10.1016/j.bmcl.2009.10.006
None	Unchecked	Ratio CC50/IC50	1.7	None	10.1016/j.bmcl.2009.02.122
None	Unchecked	Ratio CC50/IC50	2.13	None	10.1016/j.ejmech.2015.03.056
None	Unchecked	Ratio CC50/IC50	2.22	None	10.1016/j.bmcl.2013.01.046
None	Unchecked	Ratio CC50/IC50	2.42	None	10.1016/j.ejmech.2015.03.056
None	Unchecked	Ratio CC50/IC50	2.56	None	10.1016/j.bmcl.2007.08.027
None	Unchecked	Ratio CC50/IC50	2.56	None	10.1021/np070479+
None	Unchecked	Ratio CC50/IC50	2.6	None	10.1016/j.bmcl.2008.05.065
None	Unchecked	Ratio CC50/IC50	2.7	None	10.1016/j.bmcl.2009.10.006
None	Unchecked	Ratio CC50/IC50	2.77	None	10.1016/j.bmcl.2013.01.046
None	Unchecked	Ratio CC50/IC50	3.93	None	10.1016/j.bmcl.2013.01.046
None	Unchecked	Ratio CC50/IC50	5.6	None	10.1021/np500271u
None	Unchecked	Ratio CC50/IC50	22.0	None	10.1016/j.ejmech.2014.05.059
None	Unchecked	Ratio CC50/IC50	22.0	None	10.1021/np500271u
None	Unchecked	Ratio CC50/IC50	82.84	None	10.1016/j.ejmech.2015.03.056
None	Unchecked	Ratio CC50/IC50	98.0	None	10.1021/acsmedchemlett.9b00184
None	Unchecked	Ratio CC50/IC50	167.0	None	10.1016/j.ejmech.2020.112495
None	Unchecked	Ratio CC50/IC50	1000.0	None	10.1016/j.ejmech.2017.12.042
None	Unchecked	Ratio CC50/IC50	1000.0	None	10.1016/j.ejmech.2019.05.014
None	Unchecked	Ratio CC50/IC50	1000.0	None	10.1016/j.ejmech.2020.112581
None	Unchecked	Ratio CC50/IC50	2632.0	None	10.1016/j.ejmech.2007.03.005
None	Unchecked	Ratio CC50/IC50	3557.0	None	10.1016/j.bmc.2011.04.004
None	Unchecked	Ratio EC50	0.0	None	10.1016/j.ejmech.2021.113868
None	Unchecked	Ratio EC50	0.3	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio EC50	0.4	None	10.1016/j.ejmech.2021.113868
None	Unchecked	Ratio EC50	0.6	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio EC50	0.7	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio EC50	1.0	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio EC50	1.0	None	10.1016/j.ejmech.2021.113868
None	Unchecked	Ratio EC50	1.3	None	10.1016/j.ejmech.2020.112811
None	Unchecked	Ratio EC50	100.0	None	10.1128/aac.01004-07
None	Unchecked	Selectivity	nan	None	10.1016/0960-894X(95)00343-R
None	Unchecked	Selectivity Index	1.0	None	10.1016/j.ejmech.2010.11.019
None	Unchecked	Selectivity Index	1.0	None	10.1128/aac.01241-07
None	Unchecked	Selectivity Index	1.1	None	10.1016/j.ejmech.2010.11.019
None	Unchecked	Selectivity Index	4.17	None	10.1016/j.bmc.2014.12.064
None	Unchecked	Selectivity Index	5.0	None	10.1016/j.bmc.2014.12.064
None	Unchecked	Selectivity Index	7.0	None	10.1016/j.bmc.2018.12.039
None	Unchecked	Selectivity Index	9.1	None	10.1016/j.bmc.2009.05.001
None	Unchecked	Selectivity Index	9.1	None	10.1016/j.bmcl.2010.10.099
None	Unchecked	Selectivity Index	11.0	None	10.1016/j.bmc.2018.12.039
None	Unchecked	Selectivity Index	22.0	None	10.1021/acs.jnatprod.6b00671
None	Unchecked	Selectivity Index	31.3	None	10.1016/j.bmc.2010.05.076
None	Unchecked	Selectivity Index	39.0	None	10.1016/j.ejmech.2015.02.022
None	Unchecked	Selectivity Index	41.59	None	10.1016/j.bmc.2009.03.003
None	Unchecked	Selectivity Index	41.59	None	10.1016/j.bmc.2011.08.001
None	Unchecked	Selectivity Index	46.13	None	10.1016/j.ejmech.2014.11.050
None	Unchecked	Selectivity Index	221.9	None	10.1016/j.bmc.2010.11.063
None	Unchecked	Selectivity Index	417.0	None	10.1016/j.ejmech.2019.111864
None	Unchecked	Selectivity Index	1000.0	None	10.1016/j.bmc.2020.115892
None	Unchecked	Selectivity Index	20000.0	None	10.1016/j.bmc.2009.07.032
None	Unchecked	Selectivity Index	nan	None	10.1016/j.ejmech.2015.02.022
None	Unchecked	Selectivity ratio	64.97	None	10.1016/j.ejmech.2010.01.032
None	Unchecked	SI	107.0	None	10.1016/s0960-894x(03)00496-7
None	Unchecked	SI	1000.0	None	10.1016/s0960-894x(03)00496-7
None	Unchecked	SI	9014.0	None	10.1021/jm980038a

Metabolism Information

AKRT ID	Reaction	Reaction Link ID
AKRT020790	Nc1ccn([C@@H]2CS[C@H](CO)O2)c(=O)n1>>Nc1ccn([C@@H]2CS[C@H](COP(=O)(O)O)O2)c(=O)n1	enzymemap_44140