Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50220685'   

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 (Mus musculus (Mouse))	BDBM50220685 (CHEMBL410891) Show SMILES CS(=O)(=O)c1ccc(cc1)-c1occ(Cl)c(=O)c1-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H17ClO4S/c1-30(27,28)20-13-11-19(12-14-20)24-22(23(26)21(25)15-29-24)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-15H,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	91.6	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical& Health Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase 2 from freshly harvested mouse peritoneal macrophages				Bioorg Med Chem Lett 14: 2195-8 (2004) BindingDB Entry DOI: 10.7270/Q2K939PT
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