{"id":"W2010857942","doi":"10.1021/jm5015742","title":"Novel 3-Nitrotriazole-Based Amides and Carbinols as Bifunctional Antichagasic Agents","year":2015,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Trypanosoma species research and implications","field":"Medicine","cited_by":55,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Fondo Nacional de Desarrollo Científico y Tecnológico; National Institute of General Medical Sciences; School of Medicine, New York University; National Institutes of Health; Drugs for Neglected Diseases initiative; York University; Bill and Melinda Gates Foundation; NorthShore University HealthSystem; Bundesministerium für Bildung und Forschung","keywords":"Chemistry; Bifunctional; Nitroreductase; In vitro; Combinatorial chemistry; In vivo; Bioisostere; Trypanosoma cruzi; Stereochemistry; Enzyme; Chemical synthesis; Biochemistry","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001320207,0.0003517306,0.0002156893,0.0002015384,0.00009890862,0.0001486715,0.0003306085,0.0003098359,0.001190433],"category_scores_gemma":[0.00009447648,0.0000895106,0.0001663599,0.0001383238,0.0001508821,0.0002208968,0.0001345372,0.0003269176,0.0003422154],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001864647,"about_ca_system_score_gemma":0.000133392,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005008216,"about_ca_topic_score_gemma":0.0010843,"domain_scores_codex":[0.9999386,0.00001199095,0.000004376933,0.00001103168,0.0000137501,0.00002022934],"domain_scores_gemma":[0.9999613,0.000004014871,0.000009070823,0.000003736537,0.000009439146,0.00001251906],"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":[0.0002611832,0.00008731728,0.000129737,0.0002502803,0.00001192105,0.0003138404,0.00003631373,0.0004198821,0.9805456,0.0009153296,0.0002957959,0.01673286],"study_design_scores_gemma":[0.0001535647,0.00341936,0.002431303,0.00004196299,0.00006205242,0.001008487,0.00004112252,0.001720205,0.9618939,0.0001953355,0.02900582,0.00002691947],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9376853,0.0295544,0.01160515,0.0003476158,0.0002177295,0.0003210545,0.0007407898,0.0002801277,0.01924784],"genre_scores_gemma":[0.978219,0.009062797,0.007850984,0.0001624553,0.00004282595,0.0000890247,0.0004690576,0.00001776132,0.004086002],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001190433,"threshold_uncertainty_score":0.003982365,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0760219737707718,"score_gpt":0.3447585825538907,"score_spread":0.2687366087831189,"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."}}