Showing 1 to 22 of 22 entries Per page:
Compound ID
Cluster
Compound Type
Target/Cell Structure Activity Assay Description Source
Type
Relation
Value
Unit
NAs.000202 2 all-match Alcohol dehydrogenase alpha chain NAs.000202 Other = 25.0 None Michaelis-Menten constant against mammalian liver alcohol dehydrogenase (ADH) CHEMBL1127319
NAs.000202 2 all-match Solute carrier organic anion transporter family member 1B3 NAs.000202 Other = 115.39 % Inhibition of sodium fluorescein uptake in OATP1B3-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM CHEMBL3039007
NAs.000202 2 all-match Solute carrier organic anion transporter family member 1B1 NAs.000202 Other = 99.44 % Inhibition of sodium fluorescein uptake in OATP1B1-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM CHEMBL3039007
NAs.000202 2 all-match Unchecked NAs.000202 Other = 46000.0 nM Activity at yeast SIRT2 assessed as ADP-ribosyltransferase activity CHEMBL1773060
NAs.000202 2 all-match NAD-dependent deacetylase sirtuin 1 NAs.000202 Other = 80000.0 nM Activity at human SIRT1 assessed as ADP-ribosyltransferase activity CHEMBL1773060
NAs.000202 2 all-match Hepatotoxicity NAs.000202 Other None None None Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in non-rodents CHEMBL1697731
NAs.000202 2 all-match Hepatotoxicity NAs.000202 Other None None None Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in rodents CHEMBL1697731
NAs.000202 2 all-match Hepatotoxicity NAs.000202 Other None None None Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in humans CHEMBL1697731
NAs.000202 2 all-match Inosine-5'-monophosphate dehydrogenase (IMPDH) NAs.000202 Other = 100000.0 nM Inhibition of human IMPDH CHEMBL1145329
NAs.000202 2 all-match Ketopantoate reductase NAs.000202 Other = 10.0 % Inhibition of Escherichia coli KPR at 20 mM CHEMBL1145346
NAs.000202 2 all-match Ketopantoate reductase NAs.000202 Other = 6900000.0 nM Binding affinity to Escherichia coli KPR CHEMBL1145346
NAs.000202 2 all-match Estradiol 17-beta-dehydrogenase 1 NAs.000202 Other = 0.013 min-1 Tested by protection experiments to demonstrate the inactivation of estradiol dehydrogenase and the kinetic parameter Kapp was reported at a concentration of 20 uM CHEMBL1125169
NAs.000202 2 all-match Choline acetylase NAs.000202 Ki None None nM Compound was tested for inhibition of choline acetyltransferase isolated from squid head ganglia; No inhibition at 10e-4 M CHEMBL1121773
NAs.000202 2 all-match Malate dehydrogenase cytoplasmic NAs.000202 Other = 33900.0 nM In vitro inhibitory activity against pig heart cytoplasmic malate dehydrogenase (MDH), CHEMBL1124735
NAs.000202 2 all-match L-lactate dehydrogenase B chain NAs.000202 Other = 84400.0 nM In vitro inhibitory activity against pig heart lactate dehydrogenase (LDH) CHEMBL1124735
NAs.000202 2 all-match Alcohol dehydrogenase NAs.000202 Other = 22300.0 nM In vitro inhibitory activity against horse liver Alcohol dehydrogenase CHEMBL1124735
NAs.000202 2 all-match Glutamate dehydrogenase NAs.000202 Other = 20000.0 nM In vitro inhibitory activity against bovine liver glutamate dehydrogenase (GDH) CHEMBL1124735
NAs.000202 2 all-match Unchecked NAs.000202 Other = 32.0 None Michaelis-Menten constant against mammalian malate dehydrogenase (MDH) CHEMBL1127319
NAs.000202 2 all-match L-lactate dehydrogenase A chain NAs.000202 Other = 141.0 None Michaelis-Menten constant against mammalian lactate dehydrogenase (LDH) CHEMBL1127319
NAs.000202 2 all-match Glutamate dehydrogenase NAs.000202 Other = 30.0 None Michaelis-Menten constant against mammalian glutamate dehydrogenase (GDH) CHEMBL1127319
NAs.000202 2 all-match SARS-CoV-2 NAs.000202 IC50 > 20000.0 nM Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging CHEMBL4651402
NAs.000202 2 all-match SARS-CoV-2 NAs.000202 IC50 < 19952.62 nM Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging CHEMBL4651402