{"id":"W2034661714","doi":"10.1021/jm401507s","title":"Discovery and Development of Simeprevir (TMC435), a HCV NS3/4A Protease Inhibitor","year":2014,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Hepatitis C virus research","field":"Medicine","cited_by":215,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Simeprevir; Ribavirin; NS3; Hepatitis C virus; Pharmacology; Pegylated interferon; Virology; Sofosbuvir; Tolerability; Protease inhibitor (pharmacology); Protease; Hepatitis C; Daclatasvir; Medicine; Chemistry; Virus; Viral load; Biochemistry","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":false,"about_ca":true,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001251291,0.0001531831,0.0005461365,0.00008411425,0.00004385423,0.00001467457,0.0001374959,0.0001133503,0.00013781],"category_scores_gemma":[0.001646717,0.0001112486,0.00008141175,0.0001135872,0.0001929782,0.0001312084,0.00007513776,0.0005841762,0.00000447889],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001165711,"about_ca_system_score_gemma":0.0008360183,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000006321033,"about_ca_topic_score_gemma":9.383129e-7,"domain_scores_codex":[0.9977151,0.00004835286,0.0007912026,0.0001553316,0.001054943,0.0002351349],"domain_scores_gemma":[0.9985501,0.0001362942,0.0003965901,0.0001962041,0.0003121775,0.0004086291],"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":[0.001218422,0.0004350359,0.04457289,0.003668874,0.0002452033,0.0003428732,0.0009242357,0.000001283521,0.7987236,0.000005820515,0.00274154,0.1471203],"study_design_scores_gemma":[0.00533134,0.0007802969,0.01113094,0.003618876,0.0001487896,0.0007274562,0.0004795584,0.00009474497,0.9242271,0.00004785228,0.05320091,0.0002121949],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9938613,0.000953749,0.0007935265,0.0008240846,0.00005866142,0.0001651416,0.000002788997,0.000006111341,0.003334645],"genre_scores_gemma":[0.9955948,0.0001361851,0.002957678,0.0001186372,0.0007250646,0.000005531028,0.000003470837,0.00001851781,0.0004401079],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1469081,"threshold_uncertainty_score":0.4536586,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02035886182329065,"score_gpt":0.303705112231439,"score_spread":0.2833462504081484,"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."}}