Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50285514'   

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
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50285514 (4-[3-(4-Fluoro-phenyl)-1H-inden-2-yl]-benzenesulfo...) Show SMILES NS(=O)(=O)c1ccc(cc1)C1=C(c2ccccc2C1)c1ccc(F)cc1 |t:11| Show InChI InChI=1S/C21H16FNO2S/c22-17-9-5-15(6-10-17)21-19-4-2-1-3-16(19)13-20(21)14-7-11-18(12-8-14)26(23,24)25/h1-12H,13H2,(H2,23,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against human recombinant cyclooxygenase-1 enzyme				Bioorg Med Chem Lett 5: 2377-2380 (1995) Article DOI: 10.1016/0960-894X(95)00414-O BindingDB Entry DOI: 10.7270/Q2X06705
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