Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Choline/ethanolaminephosphotransferase 1' and Ligand = 'BDBM50376662'   

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
Choline/ethanolaminephosphotransferase 1 (Homo sapiens)	BDBM50376662 (CHEMBL263126) Show SMILES CC(=O)c1ccc2oc(nc2c1)-c1ccc(NC(=O)COc2ccccc2C)cc1 Show InChI InChI=1S/C24H20N2O4/c1-15-5-3-4-6-21(15)29-14-23(28)25-19-10-7-17(8-11-19)24-26-20-13-18(16(2)27)9-12-22(20)30-24/h3-13H,14H2,1-2H3,(H,25,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description inhibition of human CEPT assessed as cholesteryl ester transfer by fluorescence transfer assay				Bioorg Med Chem Lett 20: 346-9 (2010) Article DOI: 10.1016/j.bmcl.2009.10.099 BindingDB Entry DOI: 10.7270/Q2FJ2KKK
					More data for this Ligand-Target Pair