Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50107530'   

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))	BDBM50107530 (4-[4-(5-Chloro-thiophen-2-yl)-2-methyl-oxazol-5-yl...) Show SMILES Cc1nc(-c2ccc(Cl)s2)c(o1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H11ClN2O3S2/c1-8-17-13(11-6-7-12(15)21-11)14(20-8)9-2-4-10(5-3-9)22(16,18)19/h2-7H,1H3,(H2,16,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibitory activity of the compound towards human recombinant Prostaglandin G/H synthase 2 enzyme				Bioorg Med Chem Lett 12: 65-8 (2001) BindingDB Entry DOI: 10.7270/Q24F1Q1V
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