{"id":"W2044628864","doi":"10.1021/ml100029k","title":"The Discovery of Setileuton, a Potent and Selective 5-Lipoxygenase Inhibitor","year":2010,"lang":"en","type":"article","venue":"ACS Medicinal Chemistry Letters","topic":"Asthma and respiratory diseases","field":"Medicine","cited_by":80,"is_retracted":false,"has_abstract":true,"ca_institutions":"Merck Canada Inc. (Canada)","funders":"","keywords":"Potassium channel; Pharmacology; Potency; Chemistry; Drug discovery; Lipoxygenase; In vivo; Ex vivo; IC50; Leukotriene; Biochemistry; Computational biology; In vitro; Enzyme; Medicine; Biology; Immunology; Biotechnology","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":[],"consensus_categories":[],"category_scores_codex":[0.0001433291,0.0001482693,0.0002064802,0.0000176885,0.0001132888,0.00001527595,0.00009068631,0.00007503671,0.00001222762],"category_scores_gemma":[0.0001939317,0.0000888019,0.00006800715,0.00009525791,0.0005967274,0.00005582361,0.00004377761,0.0003871739,0.000001836721],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002144016,"about_ca_system_score_gemma":0.0001314894,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001416896,"about_ca_topic_score_gemma":0.000002446447,"domain_scores_codex":[0.9990051,0.00001465262,0.0002193738,0.000214571,0.0003304005,0.0002158673],"domain_scores_gemma":[0.9992608,0.0001149854,0.0001029651,0.0002658108,0.00007158029,0.0001839017],"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":[0.0002311779,0.00005331717,0.004926067,0.00015281,0.00004819595,0.00008826958,0.0001406545,3.362738e-7,0.9860507,0.000004983628,0.00504738,0.003256146],"study_design_scores_gemma":[0.001243301,0.00009617888,0.02884366,0.0001439668,0.0001624743,0.0002817939,0.0006491072,0.00001015021,0.9589417,0.00001523756,0.009469956,0.0001424514],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.99257,0.0004580843,0.00001654382,0.006206747,0.0001359748,0.0001407167,0.00001134669,0.00001991048,0.000440638],"genre_scores_gemma":[0.9974496,0.00003341806,0.0000273408,0.001607192,0.0006509341,0.00001409624,0.00001103217,0.00001486698,0.000191459],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02710894,"threshold_uncertainty_score":0.3621236,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.003966786317270594,"score_gpt":0.225626379817084,"score_spread":0.2216595934998134,"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."}}