ACS Chemical Biology · 2022 · 17 citations · 41 references
MedicineMedicinal ChemistryPharmacologyDrug DiscoveryMolecular PharmacologyNeuropharmacologyAllosteric ModulationAllosteric RegulationLigand BindingMolecular DockingProtein-ligand DockingReceptor-ligand InteractionsAllosteric BindingAllosteric Modulation Of G Protein-coupled ReceptorsAllosteric SitesG-protein-coupled ReceptorsNegative Allosteric ModulationNegative Allosteric ModulatorsPositive Allosteric ModulatorsReceptor Allosteric Sites
signaling in functional assays. The results demonstrate that virtual screens of fragment- and lead-like chemical libraries have complementary advantages and illustrate how access to high-resolution structures of GPCRs in complex with allosteric modulators can accelerate lead discovery.
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