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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 = 'BDBM50009808'   
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))		BDBM50009808
PNG
(CHEMBL277935 | [3-(3-Benzothiazol-2-yl-benzyl)-4-o...)
Show SMILES OC(=O)Cc1nn(Cc2cccc(c2)-c2nc3ccccc3s2)c(=O)c2ccccc12
Show InChI InChI=1S/C24H17N3O3S/c28-22(29)13-20-17-8-1-2-9-18(17)24(30)27(26-20)14-15-6-5-7-16(12-15)23-25-19-10-3-4-11-21(19)31-23/h1-12H,13-14H2,(H,28,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 5.70E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase (aldo-keto reductase, AKR1B1) isolated from human placenta.

J Med Chem 34: 108-22 (1991)


BindingDB Entry DOI: 10.7270/Q2513X6H
More data for this
Ligand-Target Pair