Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50207445'   

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))	BDBM50207445 (CHEMBL254377 | N-(2-(1-(4-bromobenzyl)-5-methoxy-2...) Show SMILES COc1ccc2n(Cc3ccc(Br)cc3)c(C)c(CCNC(=O)c3ccc(Cl)cc3)c2c1 Show InChI InChI=1S/C26H24BrClN2O2/c1-17-23(13-14-29-26(31)19-5-9-21(28)10-6-19)24-15-22(32-2)11-12-25(24)30(17)16-18-3-7-20(27)8-4-18/h3-12,15H,13-14,16H2,1-2H3,(H,29,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Chemical Biology and Center in Molecular Toxicology Curated by ChEMBL					Assay Description Inhibition of COX2				J Med Chem 50: 1425-41 (2007) Article DOI: 10.1021/jm0613166 BindingDB Entry DOI: 10.7270/Q2P26XTQ
					More data for this Ligand-Target Pair