Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50314587'   

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 (Homo sapiens (Human))	BDBM50314587 (2-(1-Difluoromethyl-2-oxo-1,2-dihydropyridin-4-yl)...) Show SMILES CC(C(O)=O)c1ccn(C(F)F)c(=O)c1 Show InChI InChI=1S/C9H9F2NO3/c1-5(8(14)15)6-2-3-12(9(10)11)7(13)4-6/h2-5,9H,1H3,(H,14,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of human recombinant COX2 by enzyme immuno assay				Bioorg Med Chem Lett 20: 2168-73 (2010) Article DOI: 10.1016/j.bmcl.2010.02.040 BindingDB Entry DOI: 10.7270/Q2HT2PGV
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