Pyrrole[2,3-d]azepino compounds as agonists of the farnesoid X receptor (FXR)

Autor:	Mark J. Evans, Paige Erin Mahaney, Jay E. Wrobel, Matthew L. Crawley, Ray Unwalla, Kim Callain Younghee, John F. Mehlmann, Joseph T. Lundquist, Douglas C. Harnish
Rok vydání:	2009
Předmět:	Models Molecular Agonist Molecular model Stereochemistry medicine.drug_class Clinical Biochemistry Receptors Cytoplasmic and Nuclear Pharmaceutical Science Carboxamide Biochemistry Chemical synthesis Structure-Activity Relationship chemistry.chemical_compound Drug Discovery medicine Humans Structure–activity relationship Pyrroles Molecular Biology Pyrrole Chemistry Organic Chemistry Azepines Nuclear receptor Molecular Medicine Farnesoid X receptor Protein Binding
Zdroj:	Bioorganic & Medicinal Chemistry Letters. 19:5289-5292
ISSN:	0960-894X
DOI:	10.1016/j.bmcl.2009.07.148
Popis:	Pyrrole[2,3-d]azepines have been identified as potent agonists of the farnesoid X receptor (FXR). Based on the planar X-ray crystal structure of WAY-362450 1 in the ligand binding domain and molecular modeling studies, non-planar reduced compounds were designed which led to agonists that exhibit high aqueous solubility and retain moderate in vitro potency.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_dedup___::87fc54b4c31896488fb9960b3d992553 https://doi.org/10.1016/j.bmcl.2009.07.148 Zobrazit plný text záznamu Full Text from ScienceDirect