Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM50334832'   

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))	BDBM50334832 (CHEMBL1643164 | ethyl 4-(4-(2-(4-(5-cyano-7-methyl...) Show SMILES CCOC(=O)c1ccc(cc1)N1CCN(CC(=O)Nc2ccc(cc2)-c2nc3cc(cc(C)c3o2)C#N)CC1 Show InChI InChI=1S/C30H29N5O4/c1-3-38-30(37)23-6-10-25(11-7-23)35-14-12-34(13-15-35)19-27(36)32-24-8-4-22(5-9-24)29-33-26-17-21(18-31)16-20(2)28(26)39-29/h4-11,16-17H,3,12-15,19H2,1-2H3,(H,32,36)	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	40	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human recombinant CETP-mediated triglyceride transfer by fluorescence-based assay				Bioorg Med Chem Lett 21: 558-61 (2010) Article DOI: 10.1016/j.bmcl.2010.10.062 BindingDB Entry DOI: 10.7270/Q2XK8FT1
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50334832 (CHEMBL1643164 | ethyl 4-(4-(2-(4-(5-cyano-7-methyl...) Show SMILES CCOC(=O)c1ccc(cc1)N1CCN(CC(=O)Nc2ccc(cc2)-c2nc3cc(cc(C)c3o2)C#N)CC1 Show InChI InChI=1S/C30H29N5O4/c1-3-38-30(37)23-6-10-25(11-7-23)35-14-12-34(13-15-35)19-27(36)32-24-8-4-22(5-9-24)29-33-26-17-21(18-31)16-20(2)28(26)39-29/h4-11,16-17H,3,12-15,19H2,1-2H3,(H,32,36)	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	59	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human recombinant CETP-mediated cholesteryl ester transfer by fluorescence-based assay				Bioorg Med Chem Lett 21: 558-61 (2010) Article DOI: 10.1016/j.bmcl.2010.10.062 BindingDB Entry DOI: 10.7270/Q2XK8FT1
					More data for this Ligand-Target Pair