Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50312716'   

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))	BDBM50312716 ((S)-4'-cyclohexyl-2'-cyclopentyl-3'-((S)-fluoro(4-...) Show SMILES O[C@H]1CC2(CCC2)Cc2nc(C3CCCC3)c([C@@H](F)c3ccc(cc3)C(F)(F)F)c(C3CCCCC3)c12 |r| Show InChI InChI=1S/C31H37F4NO/c32-28(20-11-13-22(14-12-20)31(33,34)35)27-25(19-7-2-1-3-8-19)26-23(36-29(27)21-9-4-5-10-21)17-30(15-6-16-30)18-24(26)37/h11-14,19,21,24,28,37H,1-10,15-18H2/t24-,28-/m0/s1	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	22	n/a	n/a	n/a	n/a	n/a	n/a
Bayer HealthCare AG Curated by ChEMBL					Assay Description Inhibition of CETP assessed as cholesterol ester transfer after 4 hrs by microemulsion based fluorescence assay				Bioorg Med Chem Lett 20: 1740-3 (2010) Article DOI: 10.1016/j.bmcl.2010.01.071 BindingDB Entry DOI: 10.7270/Q28S4Q1P
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50312716 ((S)-4'-cyclohexyl-2'-cyclopentyl-3'-((S)-fluoro(4-...) Show SMILES O[C@H]1CC2(CCC2)Cc2nc(C3CCCC3)c([C@@H](F)c3ccc(cc3)C(F)(F)F)c(C3CCCCC3)c12 |r| Show InChI InChI=1S/C31H37F4NO/c32-28(20-11-13-22(14-12-20)31(33,34)35)27-25(19-7-2-1-3-8-19)26-23(36-29(27)21-9-4-5-10-21)17-30(15-6-16-30)18-24(26)37/h11-14,19,21,24,28,37H,1-10,15-18H2/t24-,28-/m0/s1	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	60	n/a	n/a	n/a	n/a	n/a	n/a
Bayer HealthCare AG Curated by ChEMBL					Assay Description Inhibition of human plasma CETP assessed as cholesterol ester transfer after 24 hrs by fluorescence assay				Bioorg Med Chem Lett 20: 1740-3 (2010) Article DOI: 10.1016/j.bmcl.2010.01.071 BindingDB Entry DOI: 10.7270/Q28S4Q1P
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50312716 ((S)-4'-cyclohexyl-2'-cyclopentyl-3'-((S)-fluoro(4-...) Show SMILES O[C@H]1CC2(CCC2)Cc2nc(C3CCCC3)c([C@@H](F)c3ccc(cc3)C(F)(F)F)c(C3CCCCC3)c12 |r| Show InChI InChI=1S/C31H37F4NO/c32-28(20-11-13-22(14-12-20)31(33,34)35)27-25(19-7-2-1-3-8-19)26-23(36-29(27)21-9-4-5-10-21)17-30(15-6-16-30)18-24(26)37/h11-14,19,21,24,28,37H,1-10,15-18H2/t24-,28-/m0/s1	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	62	n/a	n/a	n/a	n/a	n/a	n/a
Bayer HealthCare AG Curated by ChEMBL					Assay Description Inhibition of human plasma CETP assessed as [3H]cholesterol ester transfer after 18 hrs by scintillation proximity assay				Bioorg Med Chem Lett 20: 1740-3 (2010) Article DOI: 10.1016/j.bmcl.2010.01.071 BindingDB Entry DOI: 10.7270/Q28S4Q1P
					More data for this Ligand-Target Pair