Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Aldo-keto reductase family 1 member B1' and Ligand = 'BDBM50010285'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Aldo-keto reductase family 1 member B1 (Rattus norvegicus)	BDBM50010285 (2-Chlorospiro[9H-fluorene-9,4'-isothiazolidin]-3'-...) Show SMILES Clc1ccc2-c3ccccc3C3(CS(=O)(=O)NC3=O)c2c1 Show InChI InChI=1S/C15H10ClNO3S/c16-9-5-6-11-10-3-1-2-4-12(10)15(13(11)7-9)8-21(19,20)17-14(15)18/h1-7H,8H2,(H,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Laboratories, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against L-Hexonate Dehydrogenase (L-HDH) from rat kidney (RK)				J Med Chem 34: 3229-34 (1991) BindingDB Entry DOI: 10.7270/Q2QJ7HXM
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Rattus norvegicus)	BDBM50010285 (2-Chlorospiro[9H-fluorene-9,4'-isothiazolidin]-3'-...) Show SMILES Clc1ccc2-c3ccccc3C3(CS(=O)(=O)NC3=O)c2c1 Show InChI InChI=1S/C15H10ClNO3S/c16-9-5-6-11-10-3-1-2-4-12(10)15(13(11)7-9)8-21(19,20)17-14(15)18/h1-7H,8H2,(H,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.37E+6	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Laboratories, Inc. Curated by ChEMBL					Assay Description In vitro inhibition of Aldose reductase (AR) from rat lens (RL)				J Med Chem 34: 3229-34 (1991) BindingDB Entry DOI: 10.7270/Q2QJ7HXM
					More data for this Ligand-Target Pair