BDBM50028955 CHEMBL3360272

SMILES: CC(C)c1nc2CC(C)(C)C[C@H](O)c2c2c1[C@H](OC21CCCC1)c1ccc(cn1)C(F)(F)F

InChI Key: InChIKey=YRWJRKJALJWXSQ-FDDCHVKYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50028955   

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))	BDBM50028955 (CHEMBL3360272) Show SMILES CC(C)c1nc2CC(C)(C)C[C@H](O)c2c2c1[C@H](OC21CCCC1)c1ccc(cn1)C(F)(F)F |r| Show InChI InChI=1S/C26H31F3N2O2/c1-14(2)22-20-21(19-17(31-22)11-24(3,4)12-18(19)32)25(9-5-6-10-25)33-23(20)16-8-7-15(13-30-16)26(27,28)29/h7-8,13-14,18,23,32H,5-6,9-12H2,1-4H3/t18-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma GmbH& Co. KG Curated by ChEMBL					Assay Description Inhibition of human recombinant CETP by fluorescence transfer assay				J Med Chem 57: 8766-76 (2014) Article DOI: 10.1021/jm500431d BindingDB Entry DOI: 10.7270/Q2HT2QX3
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