Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50278055'   

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 (Homo sapiens (Human))	BDBM50278055 (1,1,1-trifluoro -3-(5-(3-methoxyphenyl)-2-(3-(1,1,...) Show SMILES COc1cccc(c1)-c1cccc2N(CC(O)C(F)(F)F)C(CCc12)c1cccc(OC(F)(F)C(F)F)c1 Show InChI InChI=1S/C27H24F7NO3/c1-37-18-7-2-5-16(13-18)20-9-4-10-23-21(20)11-12-22(35(23)15-24(36)26(30,31)32)17-6-3-8-19(14-17)38-27(33,34)25(28)29/h2-10,13-14,22,24-25,36H,11-12,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research & Development Curated by ChEMBL					Assay Description Inhibition of human plasma derived CETP				Bioorg Med Chem Lett 19: 2456-60 (2009) Article DOI: 10.1016/j.bmcl.2009.03.051 BindingDB Entry DOI: 10.7270/Q2W37W6T
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