Strategies for Discovering and Derisking Covalent, Irreversible Enzyme Inhibitors
Johnson, Douglas S, Weerapana, Eranthie, Cravatt, Benjamin F·2010·Future Medicinal Chemistry
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- BindingDB Entry 50039358: Discovery of PF-04457845: A Highly Potent, Orally Bioavailable, and Selective Urea FAAH Inhibitor.BindingDB · 2013 · UC San Diego
- BindingDB Entry 50045738: Truncated structures used in search for new lead compounds and in a retrospective analysis of thienopyrimidine-based EGFR inhibitors.BindingDB · 2016 · UC San Diego
- BindingDB Entry 50021382: Structure-Based Design and Discovery of a Potent and Cell-Active LC3A/B Covalent Inhibitor.BindingDB · 2025 · UC San Diego
- BindingDB Entry 50017017: Construction of Covalent Bisubstrate Inhibitor of Protein Kinase Reacting with Cysteine Residue at Substrate-Binding Site.BindingDB · 2023 · UC San Diego
- BindingDB Entry 50005631: Structure- and reactivity-based development of covalent inhibitors of the activating and gatekeeper mutant forms of the epidermal growth factor receptor (EGFR).BindingDB · 2020 · UC San Diego
- BindingDB Entry 50003230: Covalent binding design strategy: A prospective method for discovery of potent targeted anticancer agents.BindingDB · 2020 · UC San Diego
- BindingDB Entry 50001481: Identification of the Histidine Residue in Vitamin D Receptor That Covalently Binds to Electrophilic Ligands.BindingDB · 2020 · UC San Diego
- BindingDB Entry 50001052: Synthesis and biological activity of peptide proline-boronic acids as proteasome inhibitors.BindingDB · 2020 · UC San Diego
- BindingDB Entry 50044783: Discovery and structure-activity relationship studies of irreversible benzisothiazolinone-based inhibitors against Staphylococcus aureus sortase A transpeptidase.BindingDB · 2016 · UC San Diego
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- BindingDB Entry 50015923: Discovery and biological evaluation of 1-{2,7-diazaspiro[3.5]nonan-2-yl}prop-2-en-1-one derivatives as covalent inhibitors of KRAS G12C with favorable metabolic stability and anti-tumor activity.BindingDB · 2023 · UC San Diego
- BindingDB Entry 50000297: Discovery of N-(3-(5-((3-acrylamido-4-(morpholine-4-carbonyl)phenyl)amino)-1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-2-methylphenyl)-4-(tert-butyl)benzamide (CHMFL-BTK-01) as a highly selective irreversible Bruton's tyrosine kinase (BTK) inhibitor.BindingDB · 2019 · UC San Diego