{"id":"W2063702342","doi":"10.1016/j.bmcl.2010.10.131","title":"Discovery of a 1,5-dihydrobenzo[b][1,4]diazepine-2,4-dione series of inhibitors of HIV-1 capsid assembly","year":2010,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"HIV/AIDS drug development and treatment","field":"Medicine","cited_by":104,"is_retracted":false,"has_abstract":false,"ca_institutions":"Boehringer Ingelheim (Canada)","funders":"","keywords":"Diazepine; Chemistry; Stereochemistry; Capsid; Bicyclic molecule; Imidazole; Ring (chemistry); Pyrazole; Substituent; Biochemistry; Organic chemistry","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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0002508204,0.0003256665,0.0008245722,0.000111907,0.00003464642,0.000005488557,0.0002025807,0.0001834622,0.0003210011],"category_scores_gemma":[0.0002236753,0.0002654066,0.0002041687,0.0003782349,0.0005039699,0.0001375124,0.0000785948,0.0003459627,0.000008766087],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007303971,"about_ca_system_score_gemma":0.0003172267,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004720844,"about_ca_topic_score_gemma":0.000007621283,"domain_scores_codex":[0.997775,0.00001902872,0.0008447151,0.0003541914,0.0006840692,0.0003230512],"domain_scores_gemma":[0.9986272,0.00007538147,0.0004617616,0.000525287,0.0001423124,0.0001679901],"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":[0.0002217095,0.0003105023,0.01433496,0.0009061156,0.0002899769,0.00008062245,0.0006288383,2.953708e-7,0.9776903,0.00001522768,0.005342767,0.0001787319],"study_design_scores_gemma":[0.002044135,0.00008133913,0.004989645,0.0005320087,0.0003379205,0.0002059079,0.000445296,0.000003618445,0.9900375,0.000006635942,0.001118858,0.00019716],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9895387,0.0002039737,0.00004481009,0.008830635,0.0002255429,0.0002367299,0.00005082629,0.00003500997,0.0008337313],"genre_scores_gemma":[0.9963002,0.00004929702,0.0009136896,0.0001369609,0.0003720643,0.00001083712,0.0001495026,0.00003976706,0.002027661],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01234722,"threshold_uncertainty_score":0.9999798,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006118364677811453,"score_gpt":0.2156081925006955,"score_spread":0.2094898278228841,"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."}}