{"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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0003164854,0.0004117869,0.000674158,0.0004334544,0.0001390805,0.000167248,0.00009936119,0.0002116868,0.000118113],"category_scores_gemma":[0.00005044499,0.0003303025,0.0001774736,0.0008879165,0.0005828209,0.000561382,0.0001454572,0.0006923534,0.00002479165],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002200859,"about_ca_system_score_gemma":0.0003491575,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000763909,"about_ca_topic_score_gemma":0.0001349111,"domain_scores_codex":[0.9975038,0.0000269037,0.0004357993,0.000767625,0.0006771531,0.0005887344],"domain_scores_gemma":[0.9988993,0.0001022554,0.0001111995,0.0005058149,0.00008258795,0.0002987843],"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":[0.0007749302,0.0006559662,0.0008925087,0.001008462,0.0001967961,0.0003118654,0.0003325792,9.81493e-7,0.9909049,0.0003944554,0.0007587319,0.003767805],"study_design_scores_gemma":[0.002757502,0.0005872987,0.006858853,0.001011871,0.0001556042,0.0003525295,0.0001051673,0.0002551548,0.9865308,0.00005516672,0.0009675043,0.0003625844],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.991876,0.001758876,0.0001045615,0.00197572,0.0001090156,0.000556888,0.00008454182,0.0001635493,0.00337087],"genre_scores_gemma":[0.9966916,0.0002424838,0.0001277201,0.0001103875,0.000491927,0.00004005221,0.00005856358,0.0001083166,0.002128925],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005966344,"threshold_uncertainty_score":0.9999149,"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."}}