Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50118064'   

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
Cholesteryl ester transfer protein (Oryctolagus cuniculus)	BDBM50118064 (1,1,1-Trifluoro-3-{(3-fluoro-phenyl)-[3-(3-trifluo...) Show SMILES OC(CN(Cc1cccc(Oc2cccc(c2)C(F)(F)F)c1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C23H18F7NO2/c24-17-6-3-7-18(12-17)31(14-21(32)23(28,29)30)13-15-4-1-8-19(10-15)33-20-9-2-5-16(11-20)22(25,26)27/h1-12,21,32H,13-14H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Al-Zaytoonah Private University of Jordan Curated by ChEMBL					Assay Description Inhibition of CETP in rabbit serum after 1 hr by fluorescent cholesteryl esters transfer assay				Eur J Med Chem 45: 1598-617 (2010) Article DOI: 10.1016/j.ejmech.2009.12.070 BindingDB Entry DOI: 10.7270/Q2VQ32VS
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50118064 (1,1,1-Trifluoro-3-{(3-fluoro-phenyl)-[3-(3-trifluo...) Show SMILES OC(CN(Cc1cccc(Oc2cccc(c2)C(F)(F)F)c1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C23H18F7NO2/c24-17-6-3-7-18(12-17)31(14-21(32)23(28,29)30)13-15-4-1-8-19(10-15)33-20-9-2-5-16(11-20)22(25,26)27/h1-12,21,32H,13-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia Curated by ChEMBL					Assay Description Concentration required for 50% inhibition of cholesteryl ester transfer protein in presence of buffer.				J Med Chem 45: 3891-904 (2002) BindingDB Entry DOI: 10.7270/Q2JW8D7P
					More data for this Ligand-Target Pair