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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aldo-keto reductase family 1 member B1' and Ligand = 'BDBM50016637'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Aldo-keto reductase family 1 member B1


(Homo sapiens (Human))		BDBM50016637
PNG
(5-(5-Chloro-2-methanesulfonyl-3-methyl-phenyl)-imi...)
Show SMILES Cc1cc(Cl)cc(-c2[nH]c(=O)[nH]c2O)c1S(C)(=O)=O
Show InChI InChI=1S/C11H11ClN2O4S/c1-5-3-6(12)4-7(9(5)19(2,17)18)8-10(15)14-11(16)13-8/h3-4,15H,1-2H3,(H2,13,14,16)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 270n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human placental aldose reductase (HPAR) activity with glyceraldehyde as substrate

J Med Chem 32: 1208-13 (1989)


BindingDB Entry DOI: 10.7270/Q24B309G
More data for this
Ligand-Target Pair