Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 1' and Ligand = 'BDBM50057561'   

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 (Ovis aries (Sheep))	BDBM50057561 (4-[3-Benzyloxymethyl-5-(4-chloro-phenyl)-pyrazol-1...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1nc(COCc2ccccc2)cc1-c1ccc(Cl)cc1 Show InChI InChI=1S/C23H20ClN3O3S/c24-19-8-6-18(7-9-19)23-14-20(16-30-15-17-4-2-1-3-5-17)26-27(23)21-10-12-22(13-11-21)31(25,28)29/h1-14H,15-16H2,(H2,25,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against prostaglandin G/H synthase 1 (COX-1)				J Med Chem 45: 4816-27 (2002) BindingDB Entry DOI: 10.7270/Q2XP764T
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50057561 (4-[3-Benzyloxymethyl-5-(4-chloro-phenyl)-pyrazol-1...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1nc(COCc2ccccc2)cc1-c1ccc(Cl)cc1 Show InChI InChI=1S/C23H20ClN3O3S/c24-19-8-6-18(7-9-19)23-14-20(16-30-15-17-4-2-1-3-5-17)26-27(23)21-10-12-22(13-11-21)31(25,28)29/h1-14H,15-16H2,(H2,25,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description In vitro inhibitory concentration required to block recombinant human prostaglandin G/H synthase 1 (COX-1)				J Med Chem 40: 1347-65 (1997) Article DOI: 10.1021/jm960803q BindingDB Entry DOI: 10.7270/Q2Z89BHB
					More data for this Ligand-Target Pair