{"id":"W4415936435","doi":"10.1021/acsmedchemlett.5c00510","title":"<i>S</i> -Adenosylhomocysteine Analogs Selectively Suppress Pan-Coronavirus Replication by Inhibition of nsp14 Methyltransferase","year":2025,"lang":"en","type":"article","venue":"ACS Medicinal Chemistry Letters","topic":"HIV/AIDS drug development and treatment","field":"Medicine","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"Structural Genomics Consortium; University of Toronto","funders":"National Institute of General Medical Sciences; Michigan Technology Tri-Corridor; Takeda Canada; Genentech; Ontario Genomics Institute; European Federation of Pharmaceutical Industries and Associations; Structural Genomics Consortium; Division of Cancer Prevention, National Cancer Institute; Merck KGaA; Genome Canada; National Institute of Allergy and Infectious Diseases; Bayer; Chicago Biomedical Consortium; Bristol-Myers Squibb; Office of Science; Boehringer Ingelheim; U.S. Department of Energy; Pfizer; Janssen Research and Development; Michigan Economic Development Corporation; National Science Foundation","keywords":"Methyltransferase; Docking (animal); Cytotoxicity; Enzyme; Viral replication; Plasma protein binding; Transferase; Coronavirus disease 2019 (COVID-19); Coronavirus","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000262026,0.0002713343,0.000482899,0.00008926608,0.00007513849,0.00001024265,0.0001158894,0.0001373381,0.00008768727],"category_scores_gemma":[0.0001033616,0.0002430621,0.0001024785,0.0004612418,0.000176709,0.00007568514,0.00002665217,0.0002827069,0.000007344308],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002399807,"about_ca_system_score_gemma":0.0001387919,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00007397682,"about_ca_topic_score_gemma":0.000001904047,"domain_scores_codex":[0.9981706,0.00004010686,0.0005120522,0.0005406991,0.0004435239,0.0002930711],"domain_scores_gemma":[0.9990041,0.0001182509,0.0001325229,0.0004751754,0.0001428349,0.0001270795],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0003249256,0.0002532904,0.004351667,0.0004873022,0.0003046797,0.00008731279,0.0002990934,8.526425e-7,0.9629288,0.00001272598,0.02878349,0.002165907],"study_design_scores_gemma":[0.00310638,0.00004767584,0.001881856,0.0004424309,0.0004870667,0.00006185049,0.0001612195,0.000007372637,0.9875754,0.00002605944,0.006034472,0.0001682592],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9738795,0.0007776681,0.0009682474,0.02145203,0.00005232264,0.0003973906,0.00004642464,0.00007801266,0.002348447],"genre_scores_gemma":[0.993794,0.0001033223,0.0002944294,0.002064557,0.00008062569,0.00009111519,0.0008600922,0.00002090746,0.002690914],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0246466,"threshold_uncertainty_score":0.9911786,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009360647879220184,"score_gpt":0.2719855091314359,"score_spread":0.2626248612522157,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}