Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50156243'   

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 2 (Ovis aries (Sheep))	BDBM50156243 (1-((Z)-1,2-Diphenyl-dec-1-enyl)-4-methanesulfonyl-...) Show SMILES CCCCCCCC\C(=C(/c1ccccc1)c1ccc(cc1)S(C)(=O)=O)c1ccccc1 Show InChI InChI=1S/C29H34O2S/c1-3-4-5-6-7-14-19-28(24-15-10-8-11-16-24)29(25-17-12-9-13-18-25)26-20-22-27(23-21-26)32(2,30)31/h8-13,15-18,20-23H,3-7,14,19H2,1-2H3/b29-28-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description In vitro inhibition of ovine prostaglandin G/H synthase 2				J Med Chem 47: 6108-11 (2004) Article DOI: 10.1021/jm049523y BindingDB Entry DOI: 10.7270/Q2MG7P0Z
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