Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50491245'   

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))	BDBM50491245 (CHEMBL2380929) Show SMILES [#6]C([#6])([#6])[#6]-1=[#6]\[#6](-[#6]=[#6](-[#6]-1=O)C([#6])([#6])[#6])=[#7]/[#7]-[#6](=O)-c1ccccc1 |c:7,t:4| Show InChI InChI=1S/C21H26N2O2/c1-20(2,3)16-12-15(13-17(18(16)24)21(4,5)6)22-23-19(25)14-10-8-7-9-11-14/h7-13H,1-6H3,(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of South Carolina Curated by ChEMBL					Assay Description Inhibition of sheep placental COX-2 using arachidonic acid as substrate assessed as production of PGF2alpha by enzyme immunoassay in presence of stan...				Bioorg Med Chem 21: 2551-9 (2013) Article DOI: 10.1016/j.bmc.2013.02.033 BindingDB Entry DOI: 10.7270/Q2H41VBV
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