BDBM50447556 CHEMBL3116354

SMILES: Cn1nnc(NC(Cc2ccccc2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)n1

InChI Key: InChIKey=AVUNOUZYECYSGU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50447556   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50447556 (CHEMBL3116354) Show SMILES Cn1nnc(NC(Cc2ccccc2)(c2cc(F)cc(c2)C(F)(F)F)c2ccc(Cl)cn2)n1 Show InChI InChI=1S/C22H17ClF4N6/c1-33-31-20(30-32-33)29-21(12-14-5-3-2-4-6-14,19-8-7-17(23)13-28-19)15-9-16(22(25,26)27)11-18(24)10-15/h2-11,13H,12H2,1H3,(H,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of human recombinant CETP using [3H]-CE/HDL by scintillation proximity assay				Bioorg Med Chem Lett 24: 860-4 (2014) Article DOI: 10.1016/j.bmcl.2013.12.088 BindingDB Entry DOI: 10.7270/Q2WM1FW9
					More data for this Ligand-Target Pair