BDBM50481313 CHEMBL595359

SMILES: CC(=O)c1cc(cc2nc(oc12)-c1ccc(NC(=O)COc2ccccc2C)cc1)C#N

InChI Key: InChIKey=KVRIBOSTAKRUTC-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 = 50481313   

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
Choline/ethanolaminephosphotransferase 1 (Homo sapiens)	BDBM50481313 (CHEMBL595359) Show SMILES CC(=O)c1cc(cc2nc(oc12)-c1ccc(NC(=O)COc2ccccc2C)cc1)C#N Show InChI InChI=1S/C25H19N3O4/c1-15-5-3-4-6-22(15)31-14-23(30)27-19-9-7-18(8-10-19)25-28-21-12-17(13-26)11-20(16(2)29)24(21)32-25/h3-12H,14H2,1-2H3,(H,27,30)	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description inhibition of human CEPT assessed as cholesteryl ester transfer by fluorescence transfer assay				Bioorg Med Chem Lett 20: 346-9 (2010) Article DOI: 10.1016/j.bmcl.2009.10.099 BindingDB Entry DOI: 10.7270/Q2FJ2KKK
					More data for this Ligand-Target Pair