BDBM50481332 CHEMBL593966

SMILES: Cc1ccccc1OCC(=O)Nc1ccc(cc1)-c1nc2cccc(c2o1)C(C)(C)O

InChI Key: InChIKey=KTXYFMJMHNSQHX-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 = 50481332   

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)	BDBM50481332 (CHEMBL593966) Show SMILES Cc1ccccc1OCC(=O)Nc1ccc(cc1)-c1nc2cccc(c2o1)C(C)(C)O Show InChI InChI=1S/C25H24N2O4/c1-16-7-4-5-10-21(16)30-15-22(28)26-18-13-11-17(12-14-18)24-27-20-9-6-8-19(23(20)31-24)25(2,3)29/h4-14,29H,15H2,1-3H3,(H,26,28)	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	440	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