Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aldo-keto reductase family 1 member C1' and Ligand = 'BDBM50390663'   

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 C1 (Homo sapiens (Human))	BDBM50390663 (CHEMBL2070007) Show SMILES CCCCOc1cccc(c1)C(=O)Nc1ccc(Br)cc1C(O)=O Show InChI InChI=1S/C18H18BrNO4/c1-2-3-9-24-14-6-4-5-12(10-14)17(21)20-16-8-7-13(19)11-15(16)18(22)23/h4-8,10-11H,2-3,9H2,1H3,(H,20,21)(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of recombinant AKR1C1 using 1-acenaphthenol as substrate by spectrophotometry				Bioorg Med Chem Lett 22: 5948-51 (2012) Article DOI: 10.1016/j.bmcl.2012.07.062 BindingDB Entry DOI: 10.7270/Q2BK1DFR
					More data for this Ligand-Target Pair