Exploration of the HDAC2 foot pocket: Synthesis and SAR of substituted N-(2-aminophenyl)benzamides

Autor:	Ron de Jong, Shawn M. O’Connell, Robert Melkus, Andrew John Jennings, Marc Navre, Jerome C. Bressi, Anthony R. Gangloff, Yiqin Wu, Charles E. Grimshaw, Robert J. Skene
Rok vydání:	2010
Předmět:	Molecular model medicine.drug_class Stereochemistry Clinical Biochemistry Histone Deacetylase 2 Pharmaceutical Science Carboxamide Crystal structure Crystallography X-Ray Biochemistry Chemical synthesis Structure-Activity Relationship chemistry.chemical_compound Catalytic Domain Drug Discovery medicine Humans Structure–activity relationship Benzamide Molecular Biology chemistry.chemical_classification Binding Sites Organic Chemistry Aromatic amine HCT116 Cells Receptor–ligand kinetics Histone Deacetylase Inhibitors Kinetics chemistry Benzamides Molecular Medicine
Zdroj:	Bioorganic & Medicinal Chemistry Letters. 20:3142-3145
ISSN:	0960-894X
DOI:	10.1016/j.bmcl.2010.03.091
Popis:	A series of N-(2-amino-5-substituted phenyl)benzamides (3-21) were designed, synthesized and evaluated for their inhibition of HDAC2 and their cytotoxicity in HCT116 cancer cells. Multiple compounds from this series demonstrated time-dependent binding kinetics that is rationalized using a co-complex crystal structure of HDAC2 and N-(4-aminobiphenyl-3-yl)benzamide (6).
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_dedup___::acc77bb996c8a35bb0284c71c769c99d https://doi.org/10.1016/j.bmcl.2010.03.091 Zobrazit plný text záznamu Full Text from ScienceDirect