Journal of Medicinal Chemistry · 2025 · 72 citations · 23 references
PharmacyMedicinal ChemistryPharmacologyCancer PharmacologyDrug DiscoveryMolecular OncologyLigand BindingLigand-based DesignMacrocyclic Drug DesignRas Family OncogenesTargeted Cancer TherapyTargeting LigandsOncogenic Ras MutationsOncogenic Ras SignalingOptimization Of Drug-like PropertiesRas SignalingRas Structure-function RelationshipsRas-targeted TherapiesTumor Cell ProliferationWild-type Ras Function
Oncogenic RAS mutations are among the most common in human cancers. To target the active, GTP-bound state of RAS(ON) directly, we employed an innovative tri-complex inhibitor (TCI) modality. Formation of a complex with an intracellular chaperone protein CypA, an inhibitor, and a target protein RAS blocks effector binding, inhibiting downstream RAS signaling and tumor cell proliferation. Herein, we describe the structure-guided SAR journey that led to the discovery of daraxonrasib (RMC-6236), a noncovalent, potent tri-complex inhibitor of multiple RAS mutant and wild-type (WT) variants. This orally bioavailable bRo5 macrocyclic molecule occupies a unique composite binding pocket comprising CypA and SWI/SWII regions of RAS(ON). To achieve broad-spectrum RAS isoform activity, we deployed an SAR campaign that focused on interactions with residues conserved between mutants and WT RAS isoforms. Concurrent optimization of potency and drug-like properties led to the discovery of daraxonrasib (RMC-6236), currently in clinical evaluation in RAS mutant advanced solid tumors (NCT05379985; NCT06040541; NCT06162221; NCT06445062; NCT06128551).
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Colorectal cancer statistics, 2023
Rebecca L. Siegel, Nikita Sandeep Wagle, Andrea Cercek et al. · CA A Cancer Journal for Clinicians · 2023 · 3.8K citations · Full text
K-Ras(G12C) inhibitors allosterically control GTP affinity and effector interactions
J.M. Ostrem, Ulf Peters, Martin L. Sos et al. · Nature · 2013 · 2.5K citations · Full text
Sotorasib for Lung Cancers with <i>KRAS</i> p.G12C Mutation
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Medicine, Oncology, Pharmacology +17
Acquired Resistance to KRAS <sup>G12C</sup> Inhibition in Cancer
New England Journal of Medicine · 2021 · 1.2K citations · Full text