BDBM50008463 CHEMBL424485::{4-Oxo-3-[(4-trifluoromethyl-phenylcarbamoyl)-methyl]-3,4-dihydro-phthalazin-1-yl}-acetic acid

SMILES: OC(=O)Cc1nn(CC(=O)Nc2ccc(cc2)C(F)(F)F)c(=O)c2ccccc12

InChI Key: InChIKey=XQURPZRCXFETDO-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50008463   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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 (Homo sapiens (Human))	BDBM50008463 (CHEMBL424485 | {4-Oxo-3-[(4-trifluoromethyl-phenyl...) Show SMILES OC(=O)Cc1nn(CC(=O)Nc2ccc(cc2)C(F)(F)F)c(=O)c2ccccc12 Show InChI InChI=1S/C19H14F3N3O4/c20-19(21,22)11-5-7-12(8-6-11)23-16(26)10-25-18(29)14-4-2-1-3-13(14)15(24-25)9-17(27)28/h1-8H,9-10H2,(H,23,26)(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc Curated by ChEMBL					Assay Description In vitro inhibitory activity against aldose reductase isolated from human placenta				J Med Chem 35: 457-65 (1992) BindingDB Entry DOI: 10.7270/Q28051K1
					More data for this Ligand-Target Pair