{"id":"W4405224421","doi":"10.1002/cmdc.202400629","title":"Discovery of Novel Pyrido[2,3‐<i>b</i>]Pyrazine Human Cytomegalovirus Polymerase Inhibitors with Broad Spectrum Antiherpetic Activity and Reduced hERG Inhibition","year":2024,"lang":"en","type":"article","venue":"ChemMedChem","topic":"Cytomegalovirus and herpesvirus research","field":"Medicine","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"Alberta Innovates; University of Alberta; Government of Alberta","keywords":"Human cytomegalovirus; Herpes simplex virus; Polymerase; hERG; Virology; DNA polymerase; Chemistry; Nucleoside; Cytotoxicity; Viremia; Virus; Pharmacology; Biology; Enzyme; In vitro; Biochemistry; Potassium channel","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001208301,0.0003565394,0.0002462664,0.0001777257,0.00008378381,0.0001918322,0.0002750866,0.0002250436,0.001167179],"category_scores_gemma":[0.00008448791,0.0001247183,0.0001691014,0.0001353868,0.00009791707,0.0001526153,0.000144045,0.0002651087,0.0003081232],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002376765,"about_ca_system_score_gemma":0.0002008586,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003502723,"about_ca_topic_score_gemma":0.000906955,"domain_scores_codex":[0.9999609,0.000007030608,0.00000254658,0.000007839457,0.000008949244,0.00001275428],"domain_scores_gemma":[0.9999713,0.000003979285,0.000008338231,0.000002125583,0.00000671392,0.000007613718],"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":[0.0002541649,0.0001817263,0.0002223189,0.0002710636,0.00002102325,0.0002212295,0.00003867836,0.001224663,0.9770125,0.0009414703,0.0004581285,0.01915304],"study_design_scores_gemma":[0.0002234633,0.003139214,0.002043749,0.00003753648,0.00004391072,0.0006516257,0.00002432847,0.003258421,0.9774407,0.0002193278,0.01289877,0.00001886598],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9543773,0.01488305,0.01600586,0.0002946475,0.00006968396,0.0004025605,0.0009062558,0.0002765493,0.01278414],"genre_scores_gemma":[0.9787419,0.007066824,0.008808721,0.0001995972,0.00001711343,0.0001118005,0.0005894265,0.00001775147,0.004446843],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001167179,"threshold_uncertainty_score":0.003904581,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02407858165613809,"score_gpt":0.3014514574217981,"score_spread":0.2773728757656601,"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."}}