Chemical, target, and bioactive properties of allosteric modulation.
PLoS Computational Biology, 2014 Allosteric modulators are ligands for proteins that exert their effects via a different binding site than the natural (orthosteric) ligand site and hence form a conceptually distinct class of ligands for a target of interest.
Gerard J P van Westen +2 more
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Frontiers in Molecular BiosciencesAnti-COVID19 drugs, such as nirmatrelvir, have been developed targeting the SARS-CoV-2 main protease, Mpro, based on the critical requirement of its proteolytic processing of the viral polyproteins into functional proteins essential for viral replication.
Asma Fatima +3 more
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Citation: 'allosteric site' in the IUPAC Compendium of Chemical Terminology, 5th ed.; International Union of Pure and Applied Chemistry; 2025. Online version 5.0.0, 2025. 10.1351/goldbook.14107 • License: The IUPAC Gold Book is licensed under Creative Commons Attribution-ShareAlike CC BY-SA 4.0 International for individual terms.
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Dynamic and structural insights into allosteric regulation on MKP5 a dual-specificity phosphatase
Nature CommunicationsDual-specificity mitogen-activated protein kinase (MAPK) phosphatases (MKPs) directly dephosphorylate and inactivate the MAPKs. Although the catalytic mechanism of dephosphorylation of the MAPKs by the MKPs is established, a complete molecular picture of
Erin Skeens +8 more
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Binding Modes of Xanthine-Derived Selective Allosteric Site Inhibitors of MTHFD2. [PDF]
ChemistryOpen, 2023 Jha V, Eriksson LA.
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PharmaceuticalsPositive allosteric modulators (PAMs) of the cannabinoid CB1 receptor (CB1) offer potential therapeutic advantages in the treatment of neuropathic pain and addiction by avoiding the adverse effects associated with orthosteric CB1 activation.
Hayley M. Green +4 more
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Allosteric Site at the Biotin Carboxylase Dimer Interface Mediates Activation and Inhibition in Staphylococcus aureus Pyruvate Carboxylase. [PDF]
Biochemistry, 2023 Laseke AJ +4 more
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Retraction: The Rational Design of Specific Peptide Inhibitor against p38α MAPK at Allosteric-Site: A Therapeutic Modality for HNSCC. [PDF]
PLoS One, 2023 PLOS ONE Editors.
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Substrate binding in the allosteric site mimics homotropic cooperativity in the SIS-fold glucosamine-6-phosphate deaminases. [PDF]
Protein Sci, 2023 Marcos-Viquez J +7 more
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Discovery of Hit Compounds Targeting the P4 Allosteric Site of K-RAS, Identified through Ensemble-Based Virtual Screening. [PDF]
J Chem Inf Model, 2023 Gomez-Gutierrez P +2 more
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