Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50277921'   

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))	BDBM50277921 (3-(5-(2,3-dichlorophenyl )-2-(3-(1,1,2,2-tetrafluo...) Show SMILES OC(CN1C(CCc2c1cccc2-c1cccc(Cl)c1Cl)c1cccc(OC(F)(F)C(F)F)c1)C(F)(F)F Show InChI InChI=1S/C26H20Cl2F7NO2/c27-19-8-2-7-18(23(19)28)16-6-3-9-21-17(16)10-11-20(36(21)13-22(37)25(31,32)33)14-4-1-5-15(12-14)38-26(34,35)24(29)30/h1-9,12,20,22,24,37H,10-11,13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	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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