Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50338767'   

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))	BDBM50338767 (2-(Benzyloxy)-5-chloro-N-(3-(4-methoxytetrahydro-2...) Show SMILES COC1(CCOCC1)c1cccc(CNc2cc(Cl)ccc2OCc2ccccc2)c1 Show InChI InChI=1S/C26H28ClNO3/c1-29-26(12-14-30-15-13-26)22-9-5-8-21(16-22)18-28-24-17-23(27)10-11-25(24)31-19-20-6-3-2-4-7-20/h2-11,16-17,28H,12-15,18-19H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-Sen University Curated by ChEMBL					Assay Description Inhibition of ovine COX2 assessed as PGF2alpha level by EIA				Bioorg Med Chem 19: 2074-83 (2011) Article DOI: 10.1016/j.bmc.2011.01.043 BindingDB Entry DOI: 10.7270/Q2GF0TSP
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