Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholesteryl ester transfer protein' and Ligand = 'BDBM179524'   

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))	BDBM179524 (US9126976, 55) Show SMILES O[C@H](CN1[C@@H](CN(Cc2cccc(OC(F)(F)F)c2)c2ccccc12)c1cccc2ccccc12)C(F)(F)F |r| Show InChI InChI=1S/C29H24F6N2O2/c30-28(31,32)27(38)18-37-25-14-4-3-13-24(25)36(16-19-7-5-10-21(15-19)39-29(33,34)35)17-26(37)23-12-6-9-20-8-1-2-11-22(20)23/h1-15,26-27,38H,16-18H2/t26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.43E+3	n/a	n/a	n/a	n/a	7.4	25
Merck Sharp & Dohme Corp. US Patent					Assay Description First, low density lipoprotein (LDL) (Meridian) was biotinylated by incubating LDL with biotin for 1 hour on ice, after which it was dialyzed to remo...				US Patent US9126976 (2015) BindingDB Entry DOI: 10.7270/Q25B018M
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