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name Structure Reference Source Properties Activities Metabolism

Physostigmine

AlkaPlorer ID: AK003638

Synonym: None

IUPAC Name: [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate

Structure

SMILES: CN=C(O)OC1=CC=C2C(=C1)[C@]1(C)CCN(C)[C@@H]1N2C

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InChI: InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1

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InChIKey: PIJVFDBKTWXHHD-HIFRSBDPSA-N

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Properties Information

Molecule Weight: 275.352

TPSA？: 48.30000000000001

MolLogP？: 1.9783

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bos taurus Acetylcholinesterase IC50 30.0 nM 10.1021/jm00109a009
Bos taurus Acetylcholinesterase IC50 123.0 nM 10.1016/s0960-894x(98)00076-6
Bos taurus Acetylcholinesterase IC50 146.0 nM 10.1016/s0960-894x(98)00076-6
Bos taurus Acetylcholinesterase IC50 2580.0 nM 10.1016/j.bmc.2010.01.074
Bos taurus Progesterone receptor IC50 nan None None
Bos taurus Progesterone receptor Ki nan None None
Cavia porcellus Cavia porcellus pAI50 6.5 None 10.1021/jm021055+
Cavia porcellus Leukotriene C4 synthase IC50 nan None None
Cavia porcellus Leukotriene C4 synthase Ki nan None None
Cavia porcellus Muscarinic acetylcholine receptor M3 pA2 nan None 10.1021/jm9810452
Cavia porcellus Serotonin 4 (5-HT4) receptor IC50 nan None None
Cavia porcellus Serotonin 4 (5-HT4) receptor Ki nan None None
Danio rerio Danio rerio Activity nan None 10.1021/acs.jnatprod.9b00563
Danio rerio Danio rerio Activity nan None 10.1038/nchembio.307
Electrophorus electricus Acetylcholinesterase IC50 0.034 ug.mL-1 10.1007/s00044-012-0325-2
Electrophorus electricus Acetylcholinesterase IC50 1.0 nM 10.1016/S0960-894X(01)80432-7
Electrophorus electricus Acetylcholinesterase IC50 3.0 nM 10.1021/acs.jnatprod.9b00233
Electrophorus electricus Acetylcholinesterase IC50 7.7 nM 10.1016/j.ejmech.2014.05.002
Electrophorus electricus Acetylcholinesterase IC50 7.8 nM 10.1021/acs.jnatprod.9b00563
Electrophorus electricus Acetylcholinesterase IC50 28.0 nM 10.1021/jm00171a001
Electrophorus electricus Acetylcholinesterase IC50 40.0 nM 10.1016/j.ejmech.2017.06.036
Electrophorus electricus Acetylcholinesterase IC50 41.0 nM 10.1021/np000466v
Electrophorus electricus Acetylcholinesterase IC50 41.0 nM 10.1021/np020446o
Electrophorus electricus Acetylcholinesterase IC50 46.0 nM 10.1016/s0960-894x(98)00076-6
Electrophorus electricus Acetylcholinesterase IC50 53.0 nM 10.1021/jm9014845
Electrophorus electricus Acetylcholinesterase IC50 61.0 nM 10.1021/jm00120a008
Electrophorus electricus Acetylcholinesterase IC50 90.0 nM 10.1016/j.bmc.2014.06.010
Electrophorus electricus Acetylcholinesterase IC50 90.0 nM 10.1021/ml3001825
Electrophorus electricus Acetylcholinesterase IC50 103.0 nM 10.1021/jm800564y
Electrophorus electricus Acetylcholinesterase IC50 160.0 nM 10.1016/j.bmc.2016.07.043
Electrophorus electricus Acetylcholinesterase IC50 275.0 nM 10.1016/S0960-894X(00)80545-4
Electrophorus electricus Acetylcholinesterase IC50 1170.0 nM 10.1039/c9md00559e
Electrophorus electricus Acetylcholinesterase IC50 1500.0 nM 10.1021/np960070c
Electrophorus electricus Acetylcholinesterase IC50 53000.0 nM 10.1021/jm00171a001
Electrophorus electricus Acetylcholinesterase INH 0.05 ug 10.1021/np900644x
Electrophorus electricus Acetylcholinesterase Inhibition 8.11 % 10.1016/j.ejmech.2014.05.002
Electrophorus electricus Acetylcholinesterase Inhibition 87.0 % 10.1021/np900644x
Electrophorus electricus Acetylcholinesterase Inhibition 89.33 % 10.1016/j.bmc.2012.09.040
Electrophorus electricus Acetylcholinesterase Inhibition 91.27 % 10.1016/j.ejmech.2017.06.036
Electrophorus electricus Acetylcholinesterase Inhibition 94.0 % 10.1021/np200814j
Electrophorus electricus Acetylcholinesterase Inhibition 98.0 % 10.1016/j.bmc.2020.115820
Electrophorus electricus Acetylcholinesterase Inhibition 99.8 % 10.1021/acs.jnatprod.9b00563
Electrophorus electricus Acetylcholinesterase Inhibition nan % 10.1007/s00044-012-0325-2
Electrophorus electricus Acetylcholinesterase K 0.123 /min 10.1016/j.bmc.2014.06.010
Electrophorus electricus Acetylcholinesterase K 34.3 nM 10.1016/j.bmc.2014.06.010
Electrophorus electricus Acetylcholinesterase Ki 34.0 nM 10.1021/ml3001825
Electrophorus electricus Acetylcholinesterase Ki 1000.0 nM 10.1016/0960-894X(95)00179-W
Electrophorus electricus Acetylcholinesterase MIC 0.1 ug 10.1021/np200814j
Electrophorus electricus Acetylcholinesterase Relative potency 100.0 % 10.1021/jm00120a008
Equus caballus Butyrylcholinesterase IC50 16.0 nM 10.1016/s0960-894x(98)00484-3
Equus caballus Butyrylcholinesterase IC50 73.0 nM 10.1021/jm00043a012
Equus caballus Butyrylcholinesterase IC50 3700.0 nM 10.1016/j.bmc.2012.02.044
Equus caballus Butyrylcholinesterase IC50 4666.7 nM 10.1016/S0960-894X(00)80545-4
Equus caballus Butyrylcholinesterase Ki nan None 10.1016/j.bmc.2012.02.044
Equus caballus Cholinesterase IC50 14.0 nM 10.1016/j.bmc.2014.04.050
Equus caballus Cholinesterase IC50 40.0 nM 10.1016/j.bmc.2014.06.010
Equus caballus Cholinesterase IC50 42.0 nM 10.1021/ml3001825
Equus caballus Cholinesterase IC50 60.0 nM 10.1016/j.ejmech.2014.05.002
Equus caballus Cholinesterase IC50 78.0 nM 10.1021/acs.jmedchem.5b01674
Equus caballus Cholinesterase IC50 220.0 nM 10.1016/j.bmcl.2016.05.046
Equus caballus Cholinesterase IC50 580.0 nM 10.1016/j.bmc.2016.07.043
Equus caballus Cholinesterase IC50 850.0 nM 10.1016/j.ejmech.2017.06.036
Equus caballus Cholinesterase IC50 857.0 nM 10.1021/np000466v
Equus caballus Cholinesterase IC50 1340.0 nM 10.1016/j.bmc.2010.01.074
Equus caballus Cholinesterase Inhibition 7.22 % 10.1016/j.ejmech.2014.05.002
Equus caballus Cholinesterase Inhibition 82.82 % 10.1016/j.ejmech.2017.06.036
Equus caballus Cholinesterase Inhibition 87.96 % 10.1016/j.bmc.2012.09.040
Equus caballus Cholinesterase Inhibition 93.2 % 10.1021/acs.jnatprod.9b00563
Equus caballus Cholinesterase K 0.067 /min 10.1016/j.bmc.2014.06.010
Equus caballus Cholinesterase K 0.25 /hr 10.1021/acs.jmedchem.5b01674
Equus caballus Cholinesterase K 0.3 /min 10.1021/acs.jmedchem.5b01674
Equus caballus Cholinesterase K 41.0 nM 10.1016/j.ejmech.2014.05.002
Equus caballus Cholinesterase K 41.1 nM 10.1016/j.bmc.2014.06.010
Equus caballus Cholinesterase K 280.3 nM 10.1021/acs.jmedchem.5b01674
Equus caballus Cholinesterase Ki 41.0 nM 10.1021/ml3001825
Equus caballus Cholinesterase Ratio 0.3 /uM/min 10.1021/acs.jmedchem.5b01674
Gallus gallus Acetylcholinesterase IC50 20.0 nM 10.1021/jm00187a027
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Potency 15811.4 nM None
Homo sapiens Acetylcholinesterase AC50 77.1 nM 10.1038/s41467-023-40064-9
Homo sapiens Acetylcholinesterase AC50 93.8 nM 10.1038/s41467-023-40064-9
Homo sapiens Acetylcholinesterase Activity 3.6 10'-4nmol 10.1021/np900030y
Homo sapiens Acetylcholinesterase IC50 0.008 ug.mL-1 10.1016/j.bmcl.2005.04.005
Homo sapiens Acetylcholinesterase IC50 0.013 ug.mL-1 10.1007/s00044-011-9581-9
Homo sapiens Acetylcholinesterase IC50 0.43 nM 10.1021/jm00081a022
Homo sapiens Acetylcholinesterase IC50 2.9 nM 10.1016/j.bmcl.2013.04.081
Homo sapiens Acetylcholinesterase IC50 13.49 nM 10.1021/jm0494366
Homo sapiens Acetylcholinesterase IC50 14.1 nM 10.1021/jm010914b
Homo sapiens Acetylcholinesterase IC50 14.13 nM 10.1021/jm9810452
Homo sapiens Acetylcholinesterase IC50 16.0 nM 10.1016/j.ejmech.2021.114044
Homo sapiens Acetylcholinesterase IC50 17.78 nM 10.1021/jm000991r
Homo sapiens Acetylcholinesterase IC50 17.78 nM 10.1021/jm021055+
Homo sapiens Acetylcholinesterase IC50 18.9 nM 10.1021/jm00007a005
Homo sapiens Acetylcholinesterase IC50 18.97 nM 10.1021/jm950704x
Homo sapiens Acetylcholinesterase IC50 19.0 nM 10.1021/jm00015a002
Homo sapiens Acetylcholinesterase IC50 19.0 nM 10.1021/jm00043a012
Homo sapiens Acetylcholinesterase IC50 27.9 nM 10.1016/j.bmc.2010.05.022
Homo sapiens Acetylcholinesterase IC50 27.9 nM 10.1021/jm970210v
Homo sapiens Acetylcholinesterase IC50 27.9 nM 10.1021/jm9800494
Homo sapiens Acetylcholinesterase IC50 28.0 nM 10.1016/j.ejmech.2022.114606
Homo sapiens Acetylcholinesterase IC50 28.0 nM 10.1021/jm010080x
Homo sapiens Acetylcholinesterase IC50 28.0 nM 10.1021/jm049309+
Homo sapiens Acetylcholinesterase IC50 28.0 nM 10.1021/jm050578p
Homo sapiens Acetylcholinesterase IC50 30.0 nM 10.1016/0960-894X(95)00371-Y
Homo sapiens Acetylcholinesterase IC50 30.0 nM 10.1016/j.bmcl.2005.04.005
Homo sapiens Acetylcholinesterase IC50 31.0 nM 10.1021/jm00171a001
Homo sapiens Acetylcholinesterase IC50 32.0 nM 10.1021/acs.jmedchem.5b01674
Homo sapiens Acetylcholinesterase IC50 35.0 nM 10.1021/jm00171a001
Homo sapiens Acetylcholinesterase IC50 40.0 nM 10.1007/s00044-013-0847-2
Homo sapiens Acetylcholinesterase IC50 40.0 nM 10.1016/j.bmc.2015.06.051
Homo sapiens Acetylcholinesterase IC50 43.0 nM 10.1021/jm00084a015
Homo sapiens Acetylcholinesterase IC50 43.0 nM 10.1021/jm00095a008
Homo sapiens Acetylcholinesterase IC50 47.0 nM 10.1016/s0960-894x(98)00076-6
Homo sapiens Acetylcholinesterase IC50 56.7 nM 10.1021/jm100573q
Homo sapiens Acetylcholinesterase IC50 57.0 nM 10.1021/jm950771r
Homo sapiens Acetylcholinesterase IC50 57.02 nM 10.1021/jm970488n
Homo sapiens Acetylcholinesterase IC50 61.0 nM 10.1016/S0960-894X(00)80545-4
Homo sapiens Acetylcholinesterase IC50 63.0 nM 10.1021/acs.jnatprod.9b00561
Homo sapiens Acetylcholinesterase IC50 80.0 nM 10.1016/j.bmcl.2016.05.046
Homo sapiens Acetylcholinesterase IC50 80.0 nM 10.1016/j.ejmech.2020.112718
Homo sapiens Acetylcholinesterase IC50 128.0 nM 10.1016/S0960-894X(01)81088-X
Homo sapiens Acetylcholinesterase IC50 128.0 nM 10.1021/jm00039a013
Homo sapiens Acetylcholinesterase IC50 128.0 nM 10.1021/jm00086a011
Homo sapiens Acetylcholinesterase IC50 150.0 nM 10.1016/j.bmc.2012.02.044
Homo sapiens Acetylcholinesterase IC50 160.0 nM 10.1039/C1MD00221J
Homo sapiens Acetylcholinesterase IC50 175.0 nM None
Homo sapiens Acetylcholinesterase IC50 190.0 nM 10.1039/d2md00262k
Homo sapiens Acetylcholinesterase IC50 200.0 nM 10.1016/j.bmcl.2021.128374
Homo sapiens Acetylcholinesterase IC50 220.0 nM 10.1016/j.bmc.2018.01.029
Homo sapiens Acetylcholinesterase IC50 493.17 nM 10.1016/j.bmcl.2006.08.067
Homo sapiens Acetylcholinesterase IC50 500.0 nM 10.1016/j.bmcl.2006.08.067
Homo sapiens Acetylcholinesterase IC50 538.0 nM 10.1021/acs.jnatprod.9b00759
Homo sapiens Acetylcholinesterase IC50 3390.0 nM 10.1016/j.ejmech.2021.113492
Homo sapiens Acetylcholinesterase IC50 14000.0 nM 10.1021/jm049515h
Homo sapiens Acetylcholinesterase IC50 22000.0 nM 10.1021/jm00171a001
Homo sapiens Acetylcholinesterase IC50 25000.0 nM 10.1021/jm00171a001
Homo sapiens Acetylcholinesterase IC50 nan None 10.1021/jm0503289
Homo sapiens Acetylcholinesterase Inhibition 30.0 % 10.1021/jm049515h
Homo sapiens Acetylcholinesterase Inhibition 91.27 % 10.1016/j.bmc.2015.06.051
Homo sapiens Acetylcholinesterase Inhibition 92.54 % 10.1007/s00044-013-0847-2
Homo sapiens Acetylcholinesterase Inhibition nan % 10.1021/jm0494366
Homo sapiens Acetylcholinesterase Inhibition nan % 10.1021/jm0503289
Homo sapiens Acetylcholinesterase IZ 9.0 mm 10.1016/j.ejmech.2020.112514
Homo sapiens Acetylcholinesterase k3 9.0 min-1 10.1021/jm000991r
Homo sapiens Acetylcholinesterase Kc 2.5e-07 M 10.1021/jm000991r
Homo sapiens Acetylcholinesterase Ki nan None 10.1016/j.bmc.2012.02.044
Homo sapiens Acetylcholinesterase Ki nan None None
Homo sapiens Acetylcholinesterase logIC50 1.45 None 10.1021/jm100573q
Homo sapiens Acetylcholinesterase MIC 3.6 10'-4nmol 10.1021/np800806b
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 Aldehyde dehydrogenase 1A1 Potency 14125.4 nM None
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 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 Anandamide amidohydrolase Inhibition 12.37 % 10.1016/j.bmcl.2009.09.086
Homo sapiens Anandamide amidohydrolase Inhibition 18.85 % 10.1016/j.bmcl.2009.09.086
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 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 IC50 nan None None
Homo sapiens Beta-3 adrenergic receptor Ki nan None None
Homo sapiens Bile salt export pump IC50 1000000.0 nM 10.1124/dmd.111.040758
Homo sapiens Bloom syndrome protein Potency 281.8 nM None
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 Butyrylcholinesterase Activity 0.41 uM 10.1021/jm9014845
Homo sapiens Butyrylcholinesterase IC50 15.0 nM 10.1021/jm00171a001
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1016/j.bmc.2010.05.022
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1016/j.ejmech.2021.114044
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1016/j.ejmech.2022.114606
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1021/jm010080x
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1021/jm049309+
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1021/jm050578p
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1021/jm970210v
Homo sapiens Butyrylcholinesterase IC50 16.0 nM 10.1021/jm9800494
Homo sapiens Butyrylcholinesterase IC50 19.0 nM 10.1021/jm9014845
Homo sapiens Butyrylcholinesterase IC50 22.91 nM 10.1021/jm021055+
Homo sapiens Butyrylcholinesterase IC50 22.91 nM 10.1021/jm9810452
Homo sapiens Butyrylcholinesterase IC50 23.1 nM 10.1021/jm010914b
Homo sapiens Butyrylcholinesterase IC50 26.3 nM 10.1021/jm0494366
Homo sapiens Butyrylcholinesterase IC50 28.0 nM 10.1021/jm800564y
Homo sapiens Butyrylcholinesterase IC50 35.0 nM 10.1021/jm00084a015
Homo sapiens Butyrylcholinesterase IC50 35.0 nM 10.1021/jm00095a008
Homo sapiens Butyrylcholinesterase IC50 73.0 nM 10.1021/jm00007a005
Homo sapiens Butyrylcholinesterase IC50 73.0 nM 10.1021/jm00015a002
Homo sapiens Butyrylcholinesterase IC50 129.0 nM 10.1021/jm00171a001
Homo sapiens Butyrylcholinesterase IC50 130.0 nM 10.1021/acs.jnatprod.9b00561
Homo sapiens Butyrylcholinesterase IC50 300.0 nM 10.1016/j.bmcl.2021.128374
Homo sapiens Butyrylcholinesterase IC50 850.0 nM 10.1007/s00044-013-0847-2
Homo sapiens Butyrylcholinesterase IC50 850.0 nM 10.1016/j.bmc.2015.06.051
Homo sapiens Butyrylcholinesterase IC50 850.0 nM 10.1016/j.ejmech.2019.07.059
Homo sapiens Butyrylcholinesterase IC50 857.0 nM 10.1021/np020446o
Homo sapiens Butyrylcholinesterase IC50 930.0 nM 10.1016/j.ejmech.2014.04.018
Homo sapiens Butyrylcholinesterase IC50 1164.13 nM 10.1016/j.bmcl.2006.08.067
Homo sapiens Butyrylcholinesterase IC50 1200.0 nM 10.1016/j.bmcl.2006.08.067
Homo sapiens Butyrylcholinesterase IC50 4000.0 nM 10.1021/jm00171a001
Homo sapiens Butyrylcholinesterase IC50 23000.0 nM 10.1021/jm049515h
Homo sapiens Butyrylcholinesterase IC50 26000.0 nM 10.1021/jm00171a001
Homo sapiens Butyrylcholinesterase IC50 4.365158322401666e+16 nM 10.1021/jm000991r
Homo sapiens Butyrylcholinesterase Inhibition 82.82 % 10.1016/j.bmc.2015.06.051
Homo sapiens Butyrylcholinesterase Inhibition 92.54 % 10.1007/s00044-013-0847-2
Homo sapiens Butyrylcholinesterase Inhibition 99.9 % 10.1016/j.bmcl.2021.128374
Homo sapiens Butyrylcholinesterase k3 70000.0 min-1 M-1 10.1021/jm00127a020
Homo sapiens Butyrylcholinesterase Ki 5000.0 nM 10.1021/jm00127a020
Homo sapiens Butyrylcholinesterase Ratio 0.81 None 10.1021/jm00084a015
Homo sapiens Calcitonin receptor IC50 nan None None
Homo sapiens Calcitonin receptor Ki nan None None
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 Cerebroside-sulfatase Potency 37933.0 nM None
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 Cholinesterases; ACHE & BCHE Ratio 0.8 None 10.1021/jm00095a008
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 1.6 None 10.1021/jm010914b
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 1.6 None 10.1021/jm049515h
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 1.6 None 10.1021/jm9810046
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 3.8 None 10.1021/jm00043a012
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 11.9 None 10.1016/S0960-894X(00)80547-8
Homo sapiens Cholinesterases; ACHE & BCHE Ratio 11.9 None 10.1021/jm00024a009
Homo sapiens Cholinesterases; ACHE & BCHE Ratio IC50 1.7 None 10.1016/j.bmc.2010.05.022
Homo sapiens Cholinesterases; ACHE & BCHE Ratio IC50 2.0 None 10.1021/jm050578p
Homo sapiens Cholinesterases; ACHE & BCHE Ratio IC50 2.4 None 10.1016/j.bmcl.2006.08.067
Homo sapiens Cholinesterases; ACHE & BCHE Ratio pIC50 2.0 None 10.1021/jm0494366
Homo sapiens Cholinesterases; ACHE & BCHE Selectivity 1.0 None 10.1021/jm021055+
Homo sapiens Cyclooxygenase-1 AC50 4296.1 nM 10.1038/s41467-023-40064-9
Homo sapiens Cyclooxygenase-1 AC50 10000.0 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 IC50 nan None None
Homo sapiens Cytochrome P450 2C9 Ki nan None None
Homo sapiens Cytochrome P450 2D6 IC50 200.0 nM 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 IC50 nan None None
Homo sapiens Cytochrome P450 3A4 Ki nan None None
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 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 IC50 nan None None
Homo sapiens Dopamine D4 receptor Ki nan None None
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 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 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 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 IC50 nan None None
Homo sapiens Estrogen receptor beta Ki nan None None
Homo sapiens Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Geminin Potency 1458.1 nM None
Homo sapiens Ghrelin 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 Glutaminase kidney isoform, mitochondrial Potency 12589.3 nM None
Homo sapiens Glutaminase kidney isoform, mitochondrial Potency 19952.6 nM None
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 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 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 16000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histamine H3 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histone acetyltransferase GCN5 Potency 39810.7 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 13371.4 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 44668.4 nM None
Homo sapiens HMG-CoA reductase IC50 nan None None
Homo sapiens HMG-CoA reductase Ki nan None None
Homo sapiens Homo sapiens CL 5.5 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL 22.0 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens CL_renal 16.5 mL.min-1.kg-1 10.1021/jm901371v
Homo sapiens Homo sapiens DILI_Concern nan None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens DILI_severity_class 0.0 None 10.1016/j.drudis.2016.02.015
Homo sapiens Homo sapiens F 6.0 % 10.1016/j.bmc.2007.08.060
Homo sapiens Homo sapiens Fa 0.05 None 10.1021/jm901371v
Homo sapiens Homo sapiens F_fraction 0.01 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fg 0.26 None 10.1021/jm901371v
Homo sapiens Homo sapiens Fh 0.76 None 10.1021/jm901371v
Homo sapiens Homo sapiens T1/2 0.5 hr 10.1021/acs.jmedchem.6b00609
Homo sapiens Homo sapiens Vdss 0.66 L.kg-1 10.1021/jm901371v
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 Isocitrate dehydrogenase [NADP] cytoplasmic Potency 12995.3 nM None
Homo sapiens Kappa opioid receptor AC50 2200.0 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 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 Lysine-specific demethylase 4D-like Potency 39810.7 nM None
Homo sapiens Lysosomal acid lipase/cholesteryl ester hydrolase Inhibition nan % 10.1021/jm100499s
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 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 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 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 M-phase phosphoprotein 8 Potency 31622.8 nM None
Homo sapiens Mu opioid receptor AC50 5738.2 nM 10.1038/s41467-023-40064-9
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 M1 pA2 nan None 10.1021/jm9810452
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 M2 pA2 nan None 10.1021/jm9810452
Homo sapiens Muscarinic acetylcholine receptor M2 pKb nan None 10.1021/jm021055+
Homo sapiens Muscarinic acetylcholine receptor M2 pKb nan None 10.1021/jm0494366
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 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M4 Ki nan None None
Homo sapiens Muscarinic acetylcholine receptor M5 IC50 nan None None
Homo sapiens Muscarinic acetylcholine receptor M5 Ki nan None None
Homo sapiens Neurokinin 1 receptor IC50 nan None None
Homo sapiens Neurokinin 1 receptor Ki nan None None
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 IC50 nan None None
Homo sapiens Neuropeptide Y receptor type 2 Ki nan None None
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 Nuclear factor erythroid 2-related factor 2 Potency 68589.6 nM None
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 Plasma fCmax 0.006 uM 10.1124/dmd.111.040758
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 4.0 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 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 30000.0 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 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 6 (5-HT6) receptor IC50 nan None None
Homo sapiens Serotonin 6 (5-HT6) receptor Ki nan None None
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 pKa 0.05 None 10.1021/acs.jmedchem.0c00046
Homo sapiens Serum albumin PPB 9.7 % 10.1021/acs.jmedchem.0c00046
Homo sapiens Serum albumin PPB 20.0 % 10.1021/acs.jmedchem.0c00046
Homo sapiens Sigma opioid receptor IC50 nan None None
Homo sapiens Sigma opioid receptor Ki nan None None
Homo sapiens Solute carrier organic anion transporter family member 1B1 Inhibition 78.13 % 10.1124/mol.112.084152
Homo sapiens Solute carrier organic anion transporter family member 1B3 Inhibition 80.76 % 10.1124/mol.112.084152
Homo sapiens Survival motor neuron protein Potency 28183.8 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 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 9441.1 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
Influenza A virus Nonstructural protein 1 Potency 25118.9 nM None
Mus musculus Acetylcholinesterase IC50 0.68 nM 10.1021/jm00024a009
Mus musculus Acetylcholinesterase IC50 0.69 nM 10.1021/jm00102a005
Mus musculus Acetylcholinesterase IC50 40.0 nM 10.1016/j.bmcl.2010.01.035
Mus musculus Acetylcholinesterase IC50 40.0 nM 10.1016/j.bmcl.2010.01.057
Mus musculus Butyrylcholinesterase IC50 280.0 nM 10.1016/j.bmcl.2010.01.035
Mus musculus Butyrylcholinesterase IC50 280.0 nM 10.1016/j.bmcl.2010.01.057
Mus musculus Monoamine oxidase A Activity nan None 10.1021/jm800656v
Mus musculus Muscarinic acetylcholine receptor M1 IC50 37000.0 nM 10.1021/jm00084a015
Mus musculus Muscarinic acetylcholine receptor M1 IC50 37000.0 nM 10.1021/jm00095a008
Mus musculus Muscarinic acetylcholine receptor M2 IC50 160000.0 nM 10.1021/jm00084a015
Mus musculus Muscarinic acetylcholine receptor M2 Ratio 4.4 None 10.1021/jm00084a015
Mus musculus Mus musculus Approx. lethal dose 0.8 None 10.1021/jm00095a008
Mus musculus Mus musculus Change 144.0 % 10.1021/jm00084a015
Mus musculus Mus musculus Change from control 1444.4 % 10.1021/jm00095a008
Mus musculus Mus musculus DOSE 0.32 mg.kg-1 10.1021/jm00039a013
Mus musculus Mus musculus ED50 0.0076 umol.kg-1 10.1021/jm00109a009
Mus musculus Mus musculus ED50 0.02 umol.kg-1 10.1021/jm00164a017
Mus musculus Mus musculus ED50 0.3 mg.kg-1 10.1021/jm00031a019
Mus musculus Mus musculus ED50 0.5 mg.kg-1 10.1021/jm00031a019
Mus musculus Mus musculus Improvement 36.0 % 10.1016/S0960-894X(01)81101-X
Mus musculus Mus musculus LD50 0.6 mg.kg-1 10.1021/jm00031a019
Mus musculus Mus musculus LD50 0.88 mg.kg-1 10.1021/jm00039a013
Mus musculus Mus musculus LD50 0.88 mg.kg-1 10.1021/jm00086a011
Mus musculus Mus musculus LD50 1.2 umol.kg-1 10.1021/jm00164a017
Mus musculus Mus musculus Lethal dose 0.8 mg kg-1 10.1021/jm00084a015
Mus musculus Mus musculus PD50 0.02 uM kg-1 10.1021/jm00109a009
Mus musculus Mus musculus Retention 35.0 % 10.1021/jm00135a020
Mus musculus Mus musculus Retention 45.0 % 10.1021/jm00135a020
Mus musculus Mus musculus Retention nan None 10.1021/jm00135a020
Mus musculus Mus musculus Survival 60.0 % 10.1016/S0960-894X(01)80216-X
Mus musculus Mus musculus Survival 60.0 % 10.1016/S0960-894X(01)80217-1
Mus musculus Mus musculus Survival 60.0 % 10.1016/S0960-894X(01)81101-X
Mus musculus Mus musculus Therapeutic index 40.0 None 10.1021/jm00109a009
Mus musculus Nitric oxide synthase, inducible IC50 nan None None
Mus musculus Nitric oxide synthase, inducible Ki nan None None
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
Plasmodium falciparum Plasmodium falciparum IC50 3981.07 nM 10.1038/nchembio.215
Plasmodium falciparum Plasmodium falciparum IC50 5011.87 nM 10.1038/nchembio.215
Plasmodium falciparum Plasmodium falciparum IC50 6309.57 nM 10.1038/nchembio.215
Plasmodium falciparum Plasmodium falciparum Potency 2685.5 nM None
Plasmodium falciparum Plasmodium falciparum Potency 3380.8 nM None
Plasmodium falciparum Plasmodium falciparum Potency 10417.9 nM None
Plasmodium falciparum Plasmodium falciparum Potency 13115.4 nM None
Rattus norvegicus Acetylcholinesterase Activity nan None 10.1016/S0960-894X(00)80547-8
Rattus norvegicus Acetylcholinesterase IC50 0.68 nM 10.1016/S0960-894X(00)80547-8
Rattus norvegicus Acetylcholinesterase IC50 1.0 nM 10.1016/j.bmcl.2010.01.097
Rattus norvegicus Acetylcholinesterase IC50 2.0 nM 10.1021/jm9810046
Rattus norvegicus Acetylcholinesterase IC50 11.0 nM 10.1016/j.bmc.2012.06.048
Rattus norvegicus Acetylcholinesterase IC50 14.0 nM 10.1021/jm9810046
Rattus norvegicus Acetylcholinesterase IC50 80.0 nM 10.1021/jm00015a020
Rattus norvegicus Acetylcholinesterase IC50 190.0 nM 10.1021/jm00031a019
Rattus norvegicus Acetylcholinesterase ID50 0.2 mg.kg-1 10.1021/jm00031a019
Rattus norvegicus Acetylcholinesterase ID50 1.0 mg.kg-1 10.1021/jm00031a019
Rattus norvegicus Acetylcholinesterase Inhibition nan % 10.1016/j.bmc.2012.06.048
Rattus norvegicus Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) Ratio IC50 7.0 None 10.1016/j.bmcl.2010.01.097
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 Bile salt export pump IC50 1000000.0 nM 10.1124/dmd.111.040758
Rattus norvegicus Butyrylcholinesterase IC50 7.6 nM 10.1016/j.bmcl.2010.01.097
Rattus norvegicus Butyrylcholinesterase IC50 8.1 nM 10.1016/S0960-894X(00)80547-8
Rattus norvegicus Butyrylcholinesterase IC50 8.1 nM 10.1021/jm00024a009
Rattus norvegicus Butyrylcholinesterase IC50 8.1 nM 10.1021/jm00102a005
Rattus norvegicus Butyrylcholinesterase IC50 23.0 nM 10.1021/jm9810046
Rattus norvegicus Butyrylcholinesterase IC50 58.4 nM 10.1016/j.bmc.2012.06.048
Rattus norvegicus Butyrylcholinesterase Inhibition nan % 10.1016/j.bmc.2012.06.048
Rattus norvegicus Butyrylcholinesterase Ratio 11.7 None 10.1021/jm00102a005
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 Muscarinic acetylcholine receptor M2 IC50 160000.0 nM 10.1021/jm00095a008
Rattus norvegicus Muscarinic acetylcholine receptor M2 Ratio 4.3 None 10.1021/jm00095a008
Rattus norvegicus Nitric-oxide synthase, brain IC50 nan None None
Rattus norvegicus Nitric-oxide synthase, brain Ki nan None None
Rattus norvegicus Peripheral myelin protein 22 Potency 18105.6 nM None
Rattus norvegicus Peripheral myelin protein 22 Potency 25099.9 nM None
Rattus norvegicus Rattus norvegicus ALB 40300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 41700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 43300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 305.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 342.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 370.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 416.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 50.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 52.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 56.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 64.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 80.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 86.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 87.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 99.67 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 Biodistribution 0.2 % 10.1021/jm9910223
Rattus norvegicus Rattus norvegicus Biodistribution 0.4 % 10.1021/jm9910223
Rattus norvegicus Rattus norvegicus Biodistribution 0.5 % 10.1021/jm9910223
Rattus norvegicus Rattus norvegicus BUN 146.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 150.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 153.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 220.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 105.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 107.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 600.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 623.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 673.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 786.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 187.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 226.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 386.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CK 479.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 24000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 24670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 26000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 27670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Control 40.0 % 10.1021/jm00031a019
Rattus norvegicus Rattus norvegicus Control 79.0 % 10.1021/jm00031a019
Rattus norvegicus Rattus norvegicus Control 135.0 % 10.1021/jm00031a019
Rattus norvegicus Rattus norvegicus Control 152.0 % 10.1021/jm00031a019
Rattus norvegicus Rattus norvegicus Control 286.0 % 10.1021/jm00031a019
Rattus norvegicus Rattus norvegicus CREAT 1.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.4 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 107.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 138.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 171.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 271.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 2.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1593.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1616.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1680.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1810.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 32.57 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 33.77 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 34.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.8 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 122700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 130000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 132700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 135700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Ileal activity 0.005 uM 10.1021/jm00084a015
Rattus norvegicus Rattus norvegicus Ileal activity 0.005 uM 10.1021/jm00095a008
Rattus norvegicus Rattus norvegicus LDH 93.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 95.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 115.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 200.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 7.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 8706.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10987.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 11715.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 16178.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 68.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 84.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 86.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 88.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 23.8 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.03 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.13 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 24.43 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 376700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 379000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 385700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 387000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 62.37 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 62.8 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 63.27 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 64.1 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 43.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 71.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 88.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 247.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 0.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 10.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 10.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 14.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 29.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1134.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1491.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2735.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 3645.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 123.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 133.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 133.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 139.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1062000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1091000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1231000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1244330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.92 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.09 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.15 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.49 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 57300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 58300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 61700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 64300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5080000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5420000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 5700000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.0 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 141.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 144.47 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 146.53 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 147.9 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 12.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 14.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 16.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 17.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12300.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 12570.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13570.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 19300.0 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 Thioredoxin reductase 1, cytoplasmic Potency 29934.9 nM None
Rattus norvegicus Voltage-gated L-type calcium channel alpha-1C subunit AC50 30000.0 nM 10.1038/s41467-023-40064-9
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Hit score 0.353 None 10.1101/2020.04.21.054387
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 19952.62 nM 10.6019/CHEMBL4651402
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 IC50 20000.0 nM 10.6019/CHEMBL4651402
Torpedo californica Acetylcholinesterase IC50 11.0 nM 10.1016/j.bmc.2014.04.050
Torpedo californica Acetylcholinesterase IC50 46.0 nM 10.1016/s0960-894x(98)00076-6
None ADMET K3 0.41 min-1 10.1021/jm010914b
None ADMET K5 0.43 hr-1 10.1021/jm010914b
None ADMET Kc 33.5 nM 10.1021/jm010914b
None ADMET pKa nan None 10.1021/jm021055+
None ADMET T1/2 1.0 hr 10.1021/jm970210v
None ADMET Therapeutic index 60.0 None 10.1021/jm00164a017
None Hepatotoxicity DILI positive/negative 0.0 None 10.1371/journal.pcbi.1002310
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 NON-PROTEIN TARGET Anticonvulsant activity nan None 10.1016/s0960-894x(03)00535-3
None NON-PROTEIN TARGET Potency 3981.1 nM None
None NON-PROTEIN TARGET Potency 4466.8 nM None
None NON-PROTEIN TARGET Potency 5011.9 nM None
None NON-PROTEIN TARGET Potency 7079.5 nM None
None NON-PROTEIN TARGET Potency 7943.3 nM None
None No relevant target Log PNalk -0.46 None 10.1021/jm048980b
None No relevant target Peff nan None 10.1021/acs.jnatprod.9b00561
None No relevant target pKa 7.9 None 10.1016/S0960-894X(01)80432-7
None No relevant target pKa 8.17 None 10.1007/s11095-013-1232-z
None Phospholipidosis Phospholipidosis nan None 10.1021/ci6004542
None Phospholipidosis Phospholipidosis nan None 10.1021/mp100103e
None Unchecked Ac50 19.95 uM None
None Unchecked Ac50 39.81 uM None
None Unchecked Ac50 44.67 uM None
None Unchecked AC50 19952.6 nM None
None Unchecked AC50 39810.7 nM None
None Unchecked AC50 44668.4 nM None
None Unchecked Activity 13.0 % 10.1021/np50034a023
None Unchecked IC50 360.0 nM 10.1021/jm030605g
None Unchecked IC50 nan None None
None Unchecked Inhibition nan % 10.1038/nchembio873
None Unchecked Ki nan None None
None Unchecked Potency 281.8 nM None
None Unchecked Potency 3548.1 nM None
None Unchecked Potency 10000.0 nM None
None Unchecked Potency 11220.2 nM None
None Unchecked Potency 15848.9 nM None
None Unchecked Ratio 2.7 None 10.1021/jm9014845
None Unchecked Ratio 3.8 None 10.1021/jm00015a002
None Unchecked Ratio IC50 0.047 None 10.1021/np020446o
None Unchecked Ratio IC50 0.13 None 10.1016/j.ejmech.2014.05.002
None Unchecked Ratio IC50 0.14 None 10.1016/j.bmcl.2010.01.035
None Unchecked Ratio IC50 0.14 None 10.1016/j.bmcl.2010.01.057
None Unchecked Ratio IC50 0.28 None 10.1016/j.bmc.2016.07.043
None Unchecked Ratio IC50 0.36 None 10.1016/j.bmcl.2016.05.046
None Unchecked Ratio IC50 0.48 None 10.1021/acs.jnatprod.9b00561
None Unchecked Ratio IC50 0.519 None 10.1016/j.bmc.2010.01.074
None Unchecked Ratio IC50 2.1 None 10.1021/ml3001825
None Unchecked Ratio IC50 2.14 None 10.1016/j.bmc.2014.06.010
None Unchecked Ratio IC50 2.75 None 10.1016/j.bmcl.2016.05.046
None Unchecked Ratio IC50 3.63 None 10.1016/j.bmc.2016.07.043
None Unchecked Ratio IC50 3.7 None 10.1021/jm800564y
None Unchecked Ratio IC50 5.3 None 10.1016/j.bmc.2012.06.048
None Unchecked Relative potency 0.37 None 10.1021/jm00109a009
None Unchecked Selectivity Index 0.67 None 10.1016/j.bmcl.2021.128374
None Unchecked Selectivity Index 1.5 None 10.1016/j.bmcl.2021.128374

Metabolism Information