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name Structure Reference Source Properties Activities Metabolism

Norepinephrine

AlkaPlorer ID: AK001040

Synonym: None

IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

Structure

SMILES: NC[C@H](O)C1=CC(O)=C(O)C=C1

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InChI: InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1

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InChIKey: SFLSHLFXELFNJZ-QMMMGPOBSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Bos taurus Bos Bovidae Artiodactyla Mammalia Chordata Metazoa Eukaryota
Bubalus bubalis Bubalus Bovidae Artiodactyla Mammalia Chordata Metazoa Eukaryota
Carassius auratus Carassius Cyprinidae Cypriniformes Actinopteri Chordata Metazoa Eukaryota
Sigesbeckia orientalis Sigesbeckia Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Mimosa pudica Mimosa Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Albizia julibrissin Albizia Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Paraixeris pinnatipartita Paraixeris Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Erinaceus europaeus Erinaceus Erinaceidae Eulipotyphla Mammalia Chordata Metazoa Eukaryota
Passiflora quadrangularis Passiflora Passifloraceae Malpighiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Pisum sativum Pisum Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Homo sapiens Homo Hominidae Primates Mammalia Chordata Metazoa Eukaryota
Pseudoalteromonas luteoviolacea Pseudoalteromonas Pseudoalteromonadaceae Alteromonadales Gammaproteobacteria Pseudomonadota None Bacteria
Aplysia californica Aplysia Aplysiidae Aplysiida Gastropoda Mollusca Metazoa Eukaryota
Melicope denhamii Melicope Rutaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Senecio atratus Senecio Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Mus musculus Mus Muridae Rodentia Mammalia Chordata Metazoa Eukaryota
Blatta orientalis Blatta Blattidae Blattodea Insecta Arthropoda Metazoa Eukaryota
Imperata cylindrica Imperata Poaceae Poales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Murraya paniculata Murraya Rutaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Melastoma candidum Melastoma Melastomataceae Myrtales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Hemiechinus auritus Hemiechinus Erinaceidae Eulipotyphla Mammalia Chordata Metazoa Eukaryota
Portulaca oleracea Portulaca Portulacaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Phaseolus coccineus Phaseolus Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Pittosporum resiniferum Pittosporum Pittosporaceae Apiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 169.18

TPSA？: 86.71000000000001

MolLogP？: 0.0898999999999999

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Potency 39810.7 nM None
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Potency 56234.1 nM None
Bos taurus Alpha-1a adrenergic receptor Ki 446.68 nM 10.1021/jm960354u
Bos taurus Beta-2 adrenergic receptor -Delta G nan None 10.1021/jm00401a004
Bos taurus Beta-2 adrenergic receptor Ki 6000.0 nM 10.1021/jm00073a006
Bos taurus Beta-2 adrenergic receptor Ki 6000.0 nM 10.1021/jm00084a006
Canis lupus familiaris Beta-2 adrenergic receptor Ki 5000.0 nM 10.1021/jm990599h
Canis lupus familiaris Beta-2 adrenergic receptor Ki 11000.0 nM 10.1021/jm990599h
Canis lupus familiaris Beta-2 adrenergic receptor Ki 27000.0 nM 10.1021/jm990599h
Canis lupus familiaris Canis familiaris Concentration 8.0 % kg dose g-1 10.1021/jm00368a008
Canis lupus familiaris Canis familiaris Concentration 13.8 % kg dose g-1 10.1021/jm00368a008
Canis lupus familiaris Canis familiaris Concentration 303.4 ng g-1 10.1021/jm00165a012
Canis lupus familiaris Canis familiaris Concentration 1464.8 ng g-1 10.1021/jm00165a012
Cavia porcellus Beta-1 adrenergic receptor EC50 30.0 nM 10.1021/jm00019a001
Cavia porcellus Beta-1 adrenergic receptor EC50 350.0 nM 10.1021/jm00118a019
Cavia porcellus Beta-1 adrenergic receptor EC50 10000.0 nM 10.1021/jm00019a001
Cavia porcellus Beta-1 adrenergic receptor IA 1.0 None 10.1021/jm00073a006
Cavia porcellus Beta-1 adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm00084a006
Cavia porcellus Beta-1 adrenergic receptor Ki 400.0 nM 10.1021/jm00118a019
Cavia porcellus Beta-1 adrenergic receptor pD2 6.32 None 10.1021/jm00073a006
Cavia porcellus Beta-1 adrenergic receptor pD2 6.32 None 10.1021/jm00084a006
Cavia porcellus Beta-2 adrenergic receptor EC50 213.0 nM 10.1021/jm00019a001
Cavia porcellus Beta-2 adrenergic receptor EC50 30000.0 nM 10.1021/jm00019a001
Cavia porcellus Beta-2 adrenergic receptor IA 1.0 None 10.1021/jm00073a006
Cavia porcellus Beta-2 adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm00084a006
Cavia porcellus Beta-2 adrenergic receptor pD2 6.03 None 10.1021/jm00073a006
Cavia porcellus Beta-2 adrenergic receptor pD2 6.03 None 10.1021/jm00084a006
Cavia porcellus Cavia porcellus EC50 1500.0 nM 10.1021/jm00076a024
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Potency 4456.3 nM None
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 15848.9 nM None
Homo sapiens Adenosine A1 receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A2a receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Adenosine A3 receptor AC50 22700.2 nM 10.1038/s41467-023-40064-9
Homo sapiens Adrenergic receptor alpha-1 E 100.0 None 10.1021/jm00081a008
Homo sapiens Adrenergic receptor alpha-1 Ki 2600.0 nM 10.1021/jm960012o
Homo sapiens Adrenergic receptor alpha-1 PD2 7.7 None 10.1021/jm00081a008
Homo sapiens Adrenergic receptor alpha-2 EC50 166.0 nM 10.1016/j.ejmech.2016.03.026
Homo sapiens Adrenergic receptor alpha-2 IA 1.0 None 10.1021/jm00073a006
Homo sapiens Adrenergic receptor alpha-2 Intrinsic activity 1.0 None 10.1021/jm00084a006
Homo sapiens Adrenergic receptor alpha-2 Ki 30.0 nM 10.1021/jm00118a019
Homo sapiens Adrenergic receptor alpha-2 pD2 6.56 None 10.1021/jm00073a006
Homo sapiens Adrenergic receptor alpha-2 pD2 6.56 None 10.1021/jm00084a006
Homo sapiens Adrenergic receptor beta EC50 2600.0 nM 10.1021/jm00348a014
Homo sapiens Adrenergic receptor beta Intrinsic activity 1.0 None 10.1021/jm00155a025
Homo sapiens Adrenergic receptor beta ISA nan None 10.1021/jm00119a004
Homo sapiens Adrenergic receptor beta pD2 6.04 None 10.1021/jm00155a025
Homo sapiens Adrenergic receptor beta pD2 6.5 None 10.1021/jm00155a025
Homo sapiens Adrenergic receptors; alpha-1 A & B Selectivity 0.9 None 10.1021/jm960354u
Homo sapiens Alpha-1a adrenergic receptor AC50 1.2 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 1.7 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 280.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-1a adrenergic receptor Control response 6.3 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor Control response 6.7 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor Control response 9.0 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor Control response 9.3 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor Control response 14.5 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor Control response 45.3 % 10.1021/jm00380a017
Homo sapiens Alpha-1a adrenergic receptor EC50 9.1 nM 10.1021/acs.jmedchem.5b00638
Homo sapiens Alpha-1a adrenergic receptor EC50 9.1 nM 10.1021/acs.jmedchem.6b01197
Homo sapiens Alpha-1a adrenergic receptor EC50 2187.76 nM 10.1021/jm960354u
Homo sapiens Alpha-1a adrenergic receptor Emax 117.0 % 10.1021/jm960354u
Homo sapiens Alpha-1a adrenergic receptor Ki 1500.0 nM 10.1021/jm00118a019
Homo sapiens Alpha-1b adrenergic receptor Ki 20400.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Alpha-2a adrenergic receptor AC50 5.3 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor AC50 27.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2a adrenergic receptor AC50 4147.3 nM 10.1038/s41467-023-40064-9
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 Activity nan None 10.1038/nchembio705
Homo sapiens Alpha-2a adrenergic receptor EC50 110.0 nM 10.1016/j.bmc.2010.11.020
Homo sapiens Alpha-2a adrenergic receptor EC50 118.0 nM 10.1016/j.bmc.2011.11.025
Homo sapiens Alpha-2a adrenergic receptor EC50 128.82 nM 10.1016/j.ejmech.2014.09.083
Homo sapiens Alpha-2a adrenergic receptor EC50 371.54 nM 10.1021/jm0408215
Homo sapiens Alpha-2a adrenergic receptor EC50 371.54 nM 10.1021/jm061487a
Homo sapiens Alpha-2a adrenergic receptor EC50 371.54 nM 10.1021/jm800250z
Homo sapiens Alpha-2a adrenergic receptor EC50 371.54 nM 10.1021/jm901262f
Homo sapiens Alpha-2a adrenergic receptor Emax 100.0 % 10.1016/j.bmc.2011.11.025
Homo sapiens Alpha-2a adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm0408215
Homo sapiens Alpha-2a adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm901262f
Homo sapiens Alpha-2a adrenergic receptor Ki 66.0 nM 10.1021/jm960012o
Homo sapiens Alpha-2b adrenergic receptor AC50 12.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2b adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2b adrenergic receptor EC50 61.66 nM 10.1021/jm0408215
Homo sapiens Alpha-2b adrenergic receptor EC50 61.66 nM 10.1021/jm061487a
Homo sapiens Alpha-2b adrenergic receptor EC50 61.66 nM 10.1021/jm800250z
Homo sapiens Alpha-2b adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm0408215
Homo sapiens Alpha-2b adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm901262f
Homo sapiens Alpha-2c adrenergic receptor AC50 260.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2c adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Alpha-2c adrenergic receptor EC50 794.33 nM 10.1021/jm0408215
Homo sapiens Alpha-2c adrenergic receptor EC50 794.33 nM 10.1021/jm061487a
Homo sapiens Alpha-2c adrenergic receptor EC50 794.33 nM 10.1021/jm800250z
Homo sapiens Alpha-2c adrenergic receptor EC50 794.33 nM 10.1021/jm901262f
Homo sapiens Alpha-2c adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm0408215
Homo sapiens Alpha-2c adrenergic receptor Intrinsic activity 1.0 None 10.1021/jm901262f
Homo sapiens Alpha-2c adrenergic receptor Ki 63.0 nM 10.1021/jm960012o
Homo sapiens Alpha adrenergic receptor (1a and 1d) Selectivity 0.08 None 10.1021/jm960354u
Homo sapiens Arachidonate 15-lipoxygenase, type II Potency 25118.9 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 707.9 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 2238.7 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 3548.1 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 25118.9 nM None
Homo sapiens Beta-1 adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-1 adrenergic receptor EC50 nan None 10.1021/acs.jmedchem.6b01197
Homo sapiens Beta-1 adrenergic receptor Selectivity nan None 10.1021/jm00119a004
Homo sapiens Beta-2 adrenergic receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Beta-2 adrenergic receptor -Delta G 6.0 None 10.1021/jm00401a004
Homo sapiens Beta-2 adrenergic receptor -Delta G 8.64 None 10.1021/jm00401a004
Homo sapiens Beta-2 adrenergic receptor EC50 nan None 10.1021/acs.jmedchem.6b01197
Homo sapiens Beta-2 adrenergic receptor Kd 3980.0 nM 10.1016/j.ejmech.2008.12.016
Homo sapiens Beta-2 adrenergic receptor Kd 3981.07 nM 10.1016/j.bmcl.2013.07.052
Homo sapiens Beta-2 adrenergic receptor Ki 3300.0 nM 10.1016/j.bmc.2016.04.028
Homo sapiens Beta-2 adrenergic receptor Ki 96700.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 134000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 191000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 217000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 342000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 378000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 490000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ki 1776000.0 nM 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 1.4 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 1.9 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 2.1 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 3.5 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 3.9 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 5.1 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Ratio Ki 18.4 None 10.1016/j.bmc.2009.10.015
Homo sapiens Beta-2 adrenergic receptor Selectivity nan None 10.1021/jm00119a004
Homo sapiens Beta-3 adrenergic receptor EC50 5.5 nM 10.1016/j.bmc.2007.11.060
Homo sapiens Beta-3 adrenergic receptor EC50 6.3 nM 10.1016/j.bmc.2007.11.060
Homo sapiens Beta-3 adrenergic receptor EC50 nan None 10.1021/acs.jmedchem.5b00638
Homo sapiens Beta-3 adrenergic receptor EC50 nan None 10.1021/acs.jmedchem.6b01197
Homo sapiens Beta-3 adrenergic receptor Intrinsic activity 96.0 % 10.1016/j.bmc.2007.11.060
Homo sapiens Bile salt export pump AC50 300000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Bile salt export pump IC50 1000000.0 nM 10.1124/dmd.112.047068
Homo sapiens Bloom syndrome protein Potency 3548.1 nM None
Homo sapiens Bradykinin B2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
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 Cerebroside-sulfatase Potency 30131.3 nM None
Homo sapiens Cholecystokinin A receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Cyclooxygenase-2 AC50 2400.0 nM 10.1038/s41467-023-40064-9
Homo sapiens D-amino-acid oxidase IC50 10000000.0 nM 10.1021/jm3017865
Homo sapiens D-aspartate oxidase IC50 nan None 10.1021/jm3017865
Homo sapiens Delta opioid receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens DNA-(apurinic or apyrimidinic site) lyase Potency 794.3 nM None
Homo sapiens DNA-(apurinic or apyrimidinic site) lyase Potency 891.3 nM None
Homo sapiens DNA polymerase eta Potency 1901.2 nM None
Homo sapiens DNA polymerase iota Potency 1500.3 nM None
Homo sapiens DNA polymerase kappa Potency 707.9 nM None
Homo sapiens DNA polymerase kappa Potency 8912.5 nM None
Homo sapiens DNA polymerase kappa Potency 37685.8 nM None
Homo sapiens Dopamine D1 receptor AC50 310.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D1 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D1 receptor Kd 50000.0 nM 10.1021/jm950447w
Homo sapiens Dopamine D1 receptor Log 1/Kd -4.69 None 10.1021/jm950447w
Homo sapiens Dopamine D1 receptor Potency 290.9 nM None
Homo sapiens Dopamine D1 receptor Potency 410.9 nM None
Homo sapiens Dopamine D1 receptor Potency 1995.3 nM None
Homo sapiens Dopamine D1 receptor Potency 2238.7 nM None
Homo sapiens Dopamine D2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine D2 receptor IC50 8e-05 nM 10.1021/jm00382a002
Homo sapiens Dopamine D2 receptor Ki 1300.0 nM 10.1016/j.bmc.2016.04.028
Homo sapiens Dopamine D3 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Dopamine transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Equilibrative nucleoside transporter 1 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 Flap endonuclease 1 Potency 2119.2 nM None
Homo sapiens Flap endonuclease 1 Potency 33807.8 nM None
Homo sapiens Ghrelin receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Glucagon-like peptide 1 receptor Potency 15848.9 nM None
Homo sapiens Glucocorticoid receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Glutaminase kidney isoform, mitochondrial Potency 3981.1 nM None
Homo sapiens HEK293 Potency 2058.8 nM None
Homo sapiens HEK293 Potency 35338.3 nM None
Homo sapiens HERG AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histamine H1 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 H3 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Histone acetyltransferase GCN5 Potency 17782.8 nM None
Homo sapiens Histone deacetylase 6 Inhibition -48.24 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition -4.92 % 10.6019/CHEMBL4808148
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 3981.1 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 9466.2 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 10000.0 nM None
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 Kappa opioid receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Lysine-specific demethylase 4A Potency 7943.3 nM None
Homo sapiens Melanocortin receptor 3 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Melanocortin receptor 4 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 28183.8 nM None
Homo sapiens Microtubule-associated protein tau Potency 1258.9 nM None
Homo sapiens Microtubule-associated protein tau Potency 3162.3 nM None
Homo sapiens Microtubule-associated protein tau Potency 3548.1 nM None
Homo sapiens Microtubule-associated protein tau Potency 3981.1 nM None
Homo sapiens Microtubule-associated protein tau Potency 5623.4 nM None
Homo sapiens Microtubule-associated protein tau Potency 6309.6 nM None
Homo sapiens Microtubule-associated protein tau Potency 7079.5 nM None
Homo sapiens Microtubule-associated protein tau Potency 10000.0 nM None
Homo sapiens Monoamine oxidase A AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Motilin receptor AC50 10000.0 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 Activity nan None 10.1074/jbc.m703272200
Homo sapiens Muscarinic acetylcholine receptor M1 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 M3 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Muscleblind-like protein 1 Potency 2590.2 nM None
Homo sapiens Muscleblind-like protein 1 Potency 6506.4 nM None
Homo sapiens Neuronal acetylcholine receptor protein alpha-4 subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Neuropeptide Y receptor type 1 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Nischarin Ki 100000.0 nM 10.1021/jm960012o
Homo sapiens Norepinephrine transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Norepinephrine transporter Activity 10000.0 % 10.1016/j.bmc.2009.11.032
Homo sapiens Nuclear factor erythroid 2-related factor 2 Potency 61130.6 nM None
Homo sapiens PC-3 Activity 33.0 % 10.1021/jm0580398
Homo sapiens PC-3 Activity 65.0 % 10.1021/jm0580398
Homo sapiens Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Potency 44668.4 nM None
Homo sapiens Phosphodiesterase 3A 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 Pregnane X receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Prelamin-A/C Potency 11.2 nM None
Homo sapiens Progesterone receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serine racemase IC50 nan None 10.1021/jm3017865
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 30000.0 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 2c (5-HT2c) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin 3a (5-HT3a) receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Serotonin transporter AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Solute carrier family 22 member 2 Activity nan None 10.1097/01.asn.0000019413.78751.46
Homo sapiens Solute carrier family 22 member 2 Km 1900000.0 nM 10.1124/mol.54.2.342
Homo sapiens Solute carrier family 22 member 3 Km 510000.0 nM 10.1038/1557
Homo sapiens Solute carrier organic anion transporter family member 1B1 Inhibition 112.9 % 10.1124/mol.112.084152
Homo sapiens Solute carrier organic anion transporter family member 1B3 Inhibition 102.31 % 10.1124/mol.112.084152
Homo sapiens Sulfotransferase 1A3/1A4 Activity nan None None
Homo sapiens Thromboxane A2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Type-1 angiotensin II receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Type-1 angiotensin II receptor Activity nan None 10.1021/acs.jmedchem.1c00123
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 446.7 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 501.2 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 891.3 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 2238.7 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 29092.9 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 1 Potency 56234.1 nM None
Homo sapiens Vasopressin V1a receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Vasopressin V2 receptor AC50 10000.0 nM 10.1038/s41467-023-40064-9
Homo sapiens Vitamin D receptor Potency 19952.6 nM None
Homo sapiens Vitamin D receptor Potency 50118.7 nM None
Meleagris gallopavo Erythrocyte beta receptor Delta G -7.26 None 10.1021/jm00152a017
Mesocricetus auratus Alpha-1b adrenergic receptor Ki 263.03 nM 10.1021/jm960354u
Mus musculus 3T3-L1 Activity 33.0 % 10.1021/np900608d
Mus musculus 3T3-L1 Activity 64.0 % 10.1021/np900608d
Mus musculus 3T3-L1 Activity 69.0 % 10.1021/np900608d
Mus musculus 3T3-L1 Activity 71.0 % 10.1021/np900608d
Mus musculus 3T3-L1 Activity 102.0 % 10.1021/np900608d
Mus musculus 3T3-L1 Activity 123.0 % 10.1021/np900608d
Mus musculus 3T3-L1 IC50 69.0 ug.mL-1 10.1021/np900608d
Mus musculus 3T3-L1 IC50 100.0 ug.mL-1 10.1021/np900608d
Mus musculus Alpha-2a adrenergic receptor Ki 5800.0 nM None
Mus musculus Alpha-2c adrenergic receptor Ki 650.0 nM None
Mus musculus Solute carrier family 22 member 5 Activity 70.9 % 10.1124/mol.59.2.358
Oryctolagus cuniculus Aorta Activity nan None 10.1021/np50110a010
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 0.0 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 7.8 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 18.2 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 22.2 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 46.2 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 49.1 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 63.4 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 80.2 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 84.4 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 106.3 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 112.6 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 137.2 None 10.1021/jm00111a047
Oryctolagus cuniculus Oryctolagus cuniculus Vasoconstriction effect 151.3 None 10.1021/jm00111a047
Rattus norvegicus Adrenergic receptor alpha IC50 16.0 nM 10.1021/jm00142a026
Rattus norvegicus Adrenergic receptor alpha IC50 5000.0 nM 10.1021/jm00348a014
Rattus norvegicus Adrenergic receptor alpha Intrinsic activity 1.0 None 10.1021/jm00155a025
Rattus norvegicus Adrenergic receptor alpha pD2 4.96 None 10.1021/jm00155a025
Rattus norvegicus Adrenergic receptor alpha pD2 6.16 None 10.1021/jm00155a025
Rattus norvegicus Adrenergic receptor alpha pD2 8.8 None 10.1021/jm00181a008
Rattus norvegicus Adrenergic receptor alpha Ratio 1.0 None 10.1021/jm00181a008
Rattus norvegicus Adrenergic receptor alpha Relative affinity 106.0 None 10.1021/jm00142a026
Rattus norvegicus Adrenergic receptor alpha-1 EC50 1.2 nM 10.1021/jm00019a001
Rattus norvegicus Adrenergic receptor alpha-1 EC50 200.0 nM 10.1021/jm00019a001
Rattus norvegicus Adrenergic receptor alpha-1 EC50 15800.0 nM 10.1021/jm00019a001
Rattus norvegicus Adrenergic receptor alpha-1 EC50 83200.0 nM 10.1021/jm00019a001
Rattus norvegicus Adrenergic receptor alpha-1 IA 1.0 None 10.1021/jm00073a006
Rattus norvegicus Adrenergic receptor alpha-1 IC50 1500.0 nM 10.1021/jm980284m
Rattus norvegicus Adrenergic receptor alpha-1 IC50 1620.0 nM 10.1021/jm00154a006
Rattus norvegicus Adrenergic receptor alpha-1 Inhibition 18.0 % 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor alpha-1 Intrinsic activity 1.0 None 10.1021/jm00084a006
Rattus norvegicus Adrenergic receptor alpha-1 Ki 390.0 nM 10.1021/jm00154a006
Rattus norvegicus Adrenergic receptor alpha-1 Ki 390.0 nM 10.1021/jm00389a009
Rattus norvegicus Adrenergic receptor alpha-1 Ki 450.0 nM 10.1021/jm00073a006
Rattus norvegicus Adrenergic receptor alpha-1 Ki 450.0 nM 10.1021/jm00084a006
Rattus norvegicus Adrenergic receptor alpha-1 Ki 500.0 nM 10.1021/jm00142a027
Rattus norvegicus Adrenergic receptor alpha-1 Ki 1000.0 nM 10.1021/jm00076a024
Rattus norvegicus Adrenergic receptor alpha-1 Ki 3000.0 nM 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor alpha-1 Ki 4000.0 nM 10.1021/jm00043a007
Rattus norvegicus Adrenergic receptor alpha-1 Ki 6500.0 nM 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor alpha-1 pD2 5.12 None 10.1021/jm00073a006
Rattus norvegicus Adrenergic receptor alpha-1 pD2 5.12 None 10.1021/jm00084a006
Rattus norvegicus Adrenergic receptor alpha-2 IC50 33.0 nM 10.1021/jm00154a006
Rattus norvegicus Adrenergic receptor alpha-2 IC50 750.0 nM 10.1021/jm980284m
Rattus norvegicus Adrenergic receptor alpha-2 Ki 4.8 nM 10.1021/jm00073a006
Rattus norvegicus Adrenergic receptor alpha-2 Ki 4.8 nM 10.1021/jm00084a006
Rattus norvegicus Adrenergic receptor alpha-2 Ki 17.0 nM 10.1021/jm00354a001
Rattus norvegicus Adrenergic receptor alpha-2 Ki 20.0 nM 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor alpha-2 Ki 30.0 nM 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor alpha-2 Ki 37.0 nM 10.1021/jm00154a006
Rattus norvegicus Adrenergic receptor alpha-2 Ki 37.0 nM 10.1021/jm00389a009
Rattus norvegicus Adrenergic receptor alpha-2 Ki 38.0 nM 10.1021/jm00076a024
Rattus norvegicus Adrenergic receptor alpha-2 Ki 340.0 nM 10.1021/jm990599h
Rattus norvegicus Adrenergic receptor beta EC50 52.0 nM 10.1021/jm00076a024
Rattus norvegicus Adrenergic receptor beta IC50 1000.0 nM 10.1021/jm00348a014
Rattus norvegicus Alpha-1a adrenergic receptor EC50 1174.9 nM 10.1021/jm960354u
Rattus norvegicus Alpha-1a adrenergic receptor Emax 105.0 % 10.1021/jm960354u
Rattus norvegicus Alpha-1a adrenergic receptor Ki 281.84 nM 10.1021/jm960354u
Rattus norvegicus Alpha-1b adrenergic receptor EC50 10232.93 nM 10.1021/jm960354u
Rattus norvegicus Alpha-1b adrenergic receptor Emax 215.0 % 10.1021/jm960354u
Rattus norvegicus Alpha-1d adrenergic receptor EC50 12.02 nM 10.1021/jm960354u
Rattus norvegicus Alpha-1d adrenergic receptor Emax 113.0 % 10.1021/jm960354u
Rattus norvegicus Alpha-1d adrenergic receptor Ki 22.39 nM 10.1021/jm960354u
Rattus norvegicus Alpha-2b adrenergic receptor Ki 78.0 nM 10.1021/jm960012o
Rattus norvegicus Androgen Receptor AC50 30000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Beta-1 adrenergic receptor Ki 126.0 nM 10.1021/jm00073a006
Rattus norvegicus Beta-1 adrenergic receptor Ki 126.0 nM 10.1021/jm00084a006
Rattus norvegicus Beta-1 adrenergic receptor Ki 1300.0 nM 10.1021/jm990599h
Rattus norvegicus Beta-1 adrenergic receptor Ki 1600.0 nM 10.1021/jm00076a024
Rattus norvegicus Beta-1 adrenergic receptor Ki 2700.0 nM 10.1021/jm990599h
Rattus norvegicus Beta-1 adrenergic receptor Ki 26000.0 nM 10.1021/jm990599h
Rattus norvegicus Beta-2 adrenergic receptor Activity nan None 10.1016/j.bmc.2017.10.011
Rattus norvegicus Beta-2 adrenergic receptor Ki 4200.0 nM 10.1021/jm00076a024
Rattus norvegicus Beta-3 adrenergic receptor EC50 1580.0 nM 10.1021/jm00019a001
Rattus norvegicus Beta-3 adrenergic receptor EC50 100000.0 nM 10.1021/jm00019a001
Rattus norvegicus Cyclooxygenase-1 AC50 30000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Dopamine D1 receptor KL 4141.0 nM 10.1021/jm950447w
Rattus norvegicus Dopamine D2 receptor KL 126000.0 nM 10.1021/jm950447w
Rattus norvegicus Dopamine transporter FC 100.0 None 10.1021/jm00227a030
Rattus norvegicus GABA receptor alpha-1 subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Glutamate (NMDA) receptor subunit zeta 1 AC50 10000.0 nM 10.1038/s41467-023-40064-9
Rattus norvegicus Peripheral myelin protein 22 Potency 9074.3 nM None
Rattus norvegicus Rattus norvegicus Activity 0.026 10'-6mg/kg 10.1021/jm00204a009
Rattus norvegicus Rattus norvegicus ALB 37700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 38200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 38300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 39300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 40300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 40700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 41800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALB 44700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 260.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 282.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 289.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 291.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 319.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 322.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 349.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALP 413.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 33.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 42.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 45.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 47.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 48.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 53.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus ALT 57.6 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 74.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 74.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 76.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 77.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 84.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 86.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 86.83 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus AST 89.33 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 1.5 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.6 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 1.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BILI 2.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BP 25.0 mmHg 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus BP 43.0 mmHg 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus BUN 103.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 146.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 153.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 155.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 158.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 166.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus BUN 201.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 100.83 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.17 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 101.83 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 102.6 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 103.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHLORIDE 104.33 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 570.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 653.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 706.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 715.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 724.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 726.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 750.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CHOL 1020.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 25000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 27670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 28000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 30000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 31330000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 34000000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CO2 34670000.0 nM 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Control 85.0 % 10.1021/jm00384a038
Rattus norvegicus Rattus norvegicus Control 101.0 % 10.1021/jm00384a038
Rattus norvegicus Rattus norvegicus CREAT 1.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.5 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 1.6 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.1 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus CREAT 2.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus dP/dt 5564.0 mmHg s-1 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus EOS 0.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 26.17 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 45.6 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 64.5 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 77.17 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOS 128.33 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 0.2 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 0.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus EOSLE 1.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1368.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1526.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1690.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1798.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1823.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 1874.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 2030.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus GLUC 2680.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 34.52 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 35.4 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.22 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.87 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 36.95 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 38.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 38.73 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HCT 39.53 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Heart rate 28.0 beats min-1 10.1021/jm991004l
Rattus norvegicus Rattus norvegicus HGB 126800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 128800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 131800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 134000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 135300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 140800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 143000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus HGB 144700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 104.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 105.4 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 122.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 147.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 159.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 162.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 247.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LDH 701.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.5 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 8.8 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.0 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.17 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.33 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LIPASE 9.67 U.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 10985.83 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 11603.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 12507.83 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 12875.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 13450.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 14257.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 14293.83 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYM 15398.2 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 74.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 80.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 80.6 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 80.83 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 84.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 84.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 87.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus LYMLE 90.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.18 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.36 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.42 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.62 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 21.97 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 22.03 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 22.23 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCH 22.5 pg 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 362700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 364200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 364300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 365600.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 366000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 367300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 367800.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCHC 369300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 58.17 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 58.42 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 59.03 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 59.37 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.0 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.07 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 60.27 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MCV 61.18 fL 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 234.5 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 275.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 326.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 354.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 380.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 444.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 478.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONO 562.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 1.83 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 2.17 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus MONOLE 3.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 7.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 10.33 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 12.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 13.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 16.2 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 16.5 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 17.67 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTLE 22.0 % 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1174.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1658.33 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 1753.5 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2047.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 2414.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 3216.67 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 3234.2 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus NEUTSG 3490.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus pD2 6.07 None 10.1016/s0960-894x(02)00015-x
Rattus norvegicus Rattus norvegicus PHOS 101.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 109.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 111.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 117.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 122.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 126.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 134.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PHOS 148.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 679170.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 904670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 980200.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1016000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1126000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1242330.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1311000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PLAT 1321670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.73 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.81 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 5.92 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.0 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.26 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.59 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 6.75 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus POTASSIUM 7.42 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 58300.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 58700.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 59200.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 60500.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 63400.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 64000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus PROT 68000.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus Ratio 10385.0 None 10.1021/jm00204a009
Rattus norvegicus Rattus norvegicus RBC 5640000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6100000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6110000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6140000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6270000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6430000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6590000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBC 6600000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.0 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.17 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus RBCNUC 0.33 /100WBC 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 144.7 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 144.85 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 145.52 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 146.7 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 147.8 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 147.96 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 150.2 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus SODIUM 150.5 mEq.L-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus TIME 0.008889 hr 10.1021/jm00204a009
Rattus norvegicus Rattus norvegicus Tissue Severity Score nan None 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 12.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 13.8 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 14.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 18.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 19.3 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 21.7 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 24.2 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus URATE 31.0 ug.mL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 13000.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 14900.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 15370.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 15400.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 15670.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 16380.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 17800.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Rattus norvegicus WBC 19240.0 cells.uL-1 10.6019/CHEMBL3885881
Rattus norvegicus Serotonin 2c (5-HT2c) receptor Activity nan None 10.1021/jm301656h
Rattus norvegicus Solute carrier family 22 member 1 Activity nan None 10.1016/0014-5793(96)01030-7
Rattus norvegicus Solute carrier family 22 member 1 Activity nan None 10.1038/sj.bjp.0702065
Rattus norvegicus Solute carrier family 22 member 2 IC50 11000000.0 nM 10.1074/jbc.273.49.32776
Rattus norvegicus Solute carrier family 22 member 2 Km 4400000.0 nM 10.1074/jbc.273.47.30915
Rattus norvegicus Solute carrier family 22 member 2 Km 11000000.0 nM 10.1074/jbc.273.47.30915
Rattus norvegicus Solute carrier family 22 member 3 IC50 434000.0 nM 10.1074/jbc.273.49.32776
Rattus norvegicus Solute carrier family 22 member 5 Activity nan None None
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Potency 6701.6 nM None
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Potency 21192.3 nM None
Rattus norvegicus Vesicular acetylcholine transporter Ki 10000.0 nM 10.1016/j.bmc.2012.06.040
Rattus norvegicus Voltage-gated L-type calcium channel alpha-1C subunit AC50 10000.0 nM 10.1038/s41467-023-40064-9
Severe acute respiratory syndrome coronavirus 2 Replicase polyprotein 1ab Inhibition -31.86 % 10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2 Replicase polyprotein 1ab Inhibition -11.01 % 10.6019/CHEMBL4495564
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
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition -0.21 % 10.6019/CHEMBL4495565
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition -0.04 % 10.6019/CHEMBL4495565
Trypanosoma brucei 6-phospho-1-fructokinase Potency 707.9 nM None
Trypanosoma brucei 6-phospho-1-fructokinase Potency 756.9 nM None
Trypanosoma brucei brucei Phosphoglycerate kinase, glycosomal Potency 37933.0 nM None
None ADMET Binding energy 12.1 kCal mol-1 10.1021/jm00378a021
None ADMET Kpot A,B 0.01 None 10.1016/s0960-894x(99)00395-9
None ADMET Kpot A,B 0.096 None 10.1016/s0960-894x(99)00395-9
None ADMET Kpot A,B 0.1 None 10.1016/s0960-894x(99)00395-9
None ADMET Kpot A,B 0.62 None 10.1016/s0960-894x(99)00395-9
None ADMET Kpot A,B 0.89 None 10.1016/s0960-894x(99)00395-9
None Hepatotoxicity Hepatotoxicity nan None 10.1021/tx900326k
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 0.0 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 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_jaundice 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver disease 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver fatty 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity HepSE_liver function tests abnormal 0.0 None 10.1371/journal.pcbi.1002310
None Hepatotoxicity LTKB_BD DILI severity score nan None 10.1016/j.drudis.2011.05.007
None No relevant target LogP 0.82 None 10.1016/s0960-894x(99)00395-9
None No relevant target pKa 8.58 None 10.1016/j.bmc.2007.02.026
None Unchecked Activity 0.37 mM 10.1021/jm00214a028
None Unchecked Activity 0.85 mM 10.1021/jm00214a028
None Unchecked Activity 1.3 mM 10.1021/jm00214a028
None Unchecked Activity 3.85 umol 10.1021/jm00214a028
None Unchecked Activity 8.84 umol 10.1021/jm00214a028
None Unchecked Activity 13.52 umol 10.1021/jm00214a028
None Unchecked Activity nan None 10.1038/nchembio801
None Unchecked EC50 6.6 nM 10.1021/jm00019a001
None Unchecked EC50 30.0 nM 10.1021/jm00019a001
None Unchecked EC50 112.0 nM 10.1021/jm00019a001
None Unchecked EC50 150.0 nM 10.1021/jm00344a009
None Unchecked EC50 2000.0 nM 10.1021/jm00019a001
None Unchecked EC50 12000.0 nM 10.1021/jm00019a001
None Unchecked EC50 14500.0 nM 10.1021/jm00019a001
None Unchecked ED50 1.1 uM 10.1021/jm00199a013
None Unchecked FC 100.0 None 10.1021/jm00227a030
None Unchecked Ki 3310.0 nM 10.1038/nchembio801
None Unchecked Ki 4580.0 nM 10.1038/nchembio801
None Unchecked -Log KD -0.88 None 10.1021/jm00354a004
None Unchecked pKb 3.7 None 10.1021/jm00207a015
None Unchecked Potency 10000.0 nM None
None Unchecked Potency 14068.4 nM None
None Unchecked Potency 15848.9 nM None
None Unchecked Potency 28183.8 nM None
None Unchecked Potency 35481.3 nM None
None Unchecked Ratio 50.0 None 10.1021/jm00118a019
None Unchecked Ratio Ki 0.39 None 10.1016/j.bmc.2016.04.028

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT004418 CC(=O)[32S].NC[C@H](O)c1ccc(O)c(O)c1>>CC(=O)NC[C@H](O)c1ccc(O)c(O)c1 None
AKRT004663 CC(=O)[CoA].NC[C@H](O)c1ccc(O)c(O)c1>>CC(=O)NC[C@H](O)c1ccc(O)c(O)c1 enzymemap_32412
AKRT010815 CN[C@@H](CCC(N)=O)C(C)=O.NC[C@H](O)c1ccc(O)c(O)c1>>CN[C@@H](CCC(=O)NC[C@H](O)c1ccc(O)c(O)c1)C(C)=O 66560
AKRT011512 COc1cc(/C=C/C(=O)[CoA])ccc1O.NC[C@H](O)c1ccc(O)c(O)c1>>COc1cc(/C=C/C(=O)NC[C@H](O)c2ccc(O)c(O)c2)ccc1O enzymemap_28456
AKRT014663 C[SAH].NC[C@H](O)c1ccc(O)c(O)c1>>CNC[C@H](O)c1ccc(O)c(O)c1 RXN66-241
AKRT014664 C[SAH].NC[C@H](O)c1ccc(O)c(O)c1>>COc1cc([C@@H](O)CN)ccc1O RXN-10906
AKRT018398 NCCc1ccc(O)c(O)c1>>NC[C@H](O)c1ccc(O)c(O)c1 DOPAMINE-BETA-MONOOXYGENASE-RXN
AKRT018474 NC[C@H](O)c1ccc(O)c(O)c1>>NC[C@H](O)c1ccc(OS(=O)(=O)O)c(O)c1 enzymemap_49936
AKRT018475 NC[C@H](O)c1ccc(O)c(O)c1>>O=C1C=C2C(=NCC2O)CC1=O MNXR104047
AKRT018476 NC[C@H](O)c1ccc(O)c(O)c1>>O=CC(O)c1ccc(O)c(O)c1 R02532
AKRT018477 NC[C@H](O)c1ccc(O)c(O)c1>>O=C[C@H](O)c1ccc(O)c(O)c1 RXN-10907
AKRT018478 NC[C@H](O)c1ccc(O)c(O)c1>>O=S(=O)(O)NC[C@H](O)c1ccc(O)c(O)c1 enzymemap_50516
AKRT018480 NC[C@H](O)c1ccc(OS(=O)(=O)O)c(O)c1>>NC[C@H](O)c1ccc(O)c(O)c1 MNXR102016
AKRT024870 Oc1cc2c(cc1O)C(O)CNC2>>NC[C@H](O)c1ccc(O)c(O)c1 MNXR103619