Document Report Card

Basic Information

ID: ALA4732214

Journal: J Med Chem

Title: Highly Selective Y Receptor Antagonist Binds in an Allosteric Binding Pocket.

Authors: Schüß C,Vu O,Schubert M,Du Y,Mishra NM,Tough IR,Stichel J,Weaver CD,Emmitte KA,Cox HM,Meiler J,Beck-Sickinger AG

Abstract: Human neuropeptide Y receptors (YR, YR, YR, and YR) belong to the superfamily of G protein-coupled receptors and play an important role in the regulation of food intake and energy metabolism. We identified and characterized the first selective YR allosteric antagonist (S)-VU0637120, an important step toward validating Y receptors as therapeutic targets for metabolic diseases. To obtain insight into the antagonistic mechanism of (S)-VU0637120, we conducted a variety of in vitro, ex vivo, and in silico studies. These studies revealed that (S)-VU0637120 selectively inhibits native YR function and binds in an allosteric site located below the binding pocket of the endogenous ligand pancreatic polypeptide in the core of the YR transmembrane domains. Taken together, our studies provide a first-of-its-kind tool for probing YR function and improve the general understanding of allosteric modulation, ultimately contributing to the rational development of allosteric modulators for peptide-activated G protein-coupled receptors (GPCRs).

CiteXplore: 33595306

DOI: 10.1021/acs.jmedchem.0c02000