Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50332341'   

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))	BDBM50332341 (1-(5-(2-(benzyloxy)phenyl)-3-(4-(methylsulfonyl)ph...) Show SMILES CC(=O)N1N=C(CC1c1ccccc1OCc1ccccc1)c1ccc(cc1)S(C)(=O)=O |c:4| Show InChI InChI=1S/C25H24N2O4S/c1-18(28)27-24(16-23(26-27)20-12-14-21(15-13-20)32(2,29)30)22-10-6-7-11-25(22)31-17-19-8-4-3-5-9-19/h3-15,24H,16-17H2,1-2H3	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	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant COX2 expressed in baculovirus infected SF21 cell				Eur J Med Chem 45: 6135-8 (2010) Article DOI: 10.1016/j.ejmech.2010.10.005 BindingDB Entry DOI: 10.7270/Q2PV6KMT
					More data for this Ligand-Target Pair