{"id":"W2023563124","doi":"10.1021/jm0494523","title":"A Systematic Approach to the Optimization of Substrate-Based Inhibitors of the Hepatitis C Virus NS3 Protease:  Discovery of Potent and Specific Tripeptide Inhibitors","year":2004,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Hepatitis C virus research","field":"Medicine","cited_by":122,"is_retracted":false,"has_abstract":true,"ca_institutions":"Boehringer Ingelheim (Canada)","funders":"","keywords":"Tripeptide; Chemistry; NS3; Tetrapeptide; Serine protease; Protease; Proteases; Biochemistry; Peptide; Enzyme; Stereochemistry","routes":{"ca_aff":true,"ca_fund":false,"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":[0.0005031888,0.0009840745,0.0008488165,0.0007013896,0.0002763151,0.000723082,0.0007088782,0.000412245,0.0008161531],"category_scores_gemma":[0.0004562619,0.0004228188,0.0004137809,0.0005637836,0.0003804403,0.0004643631,0.0005884559,0.00105953,0.0003853488],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003438132,"about_ca_system_score_gemma":0.0006312118,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003520378,"about_ca_topic_score_gemma":0.001027076,"domain_scores_codex":[0.9996314,0.00008182705,0.00005668773,0.00006617734,0.0001086894,0.00005522194],"domain_scores_gemma":[0.9997767,0.00003736049,0.00006373574,0.00003766392,0.00004565321,0.00003894914],"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":[0.0001830635,0.0003117236,0.000225542,0.000231898,0.00004140569,0.0001929241,0.00005086894,0.002960235,0.9740492,0.0005855151,0.0001421104,0.02102552],"study_design_scores_gemma":[0.0001688765,0.003630389,0.0008782401,0.0000274656,0.0001023675,0.0008190924,0.00003668107,0.002786737,0.9835951,0.0002337392,0.007688995,0.00003229606],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8842695,0.01565034,0.08841456,0.000506461,0.0001086832,0.002176794,0.00099626,0.0004848056,0.007392699],"genre_scores_gemma":[0.8668697,0.02188309,0.1059767,0.00036043,0.00005790578,0.0007719438,0.001173837,0.0001086254,0.002797802],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0009840745,"threshold_uncertainty_score":0.00273037,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01590629225542289,"score_gpt":0.2507657254065621,"score_spread":0.2348594331511392,"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."}}