Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM254033'   

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))	BDBM254033 (US9493430, 572) Show SMILES COC(=O)c1ccc(c(C)c1)-c1cc(C2=C(CN3[C@@H](C)[C@H](OC3=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F)CC(C)(C)CC2)c(OC)cc1F |r,c:15| Show InChI InChI=1S/C37H36F7NO5/c1-19-11-21(33(46)49-6)7-8-26(19)28-15-29(31(48-5)16-30(28)38)27-9-10-35(3,4)17-23(27)18-45-20(2)32(50-34(45)47)22-12-24(36(39,40)41)14-25(13-22)37(42,43)44/h7-8,11-16,20,32H,9-10,17-18H2,1-6H3/t20-,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Chong Kun Dang Pharmaceutical Corp. US Patent					Assay Description As a protein source for cholesteryl ester transfer, plasma from healthy persons was used, and as a cholesteryl ester receptor, LDL from healthy perso...				US Patent US9493430 (2016) BindingDB Entry DOI: 10.7270/Q2W37V7V
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