{"id":"W2320320934","doi":"10.1021/jm501740a","title":"The Discovery of Orally Bioavailable Tyrosine Threonine Kinase (TTK) Inhibitors: 3-(4-(heterocyclyl)phenyl)-1<i>H</i>-indazole-5-carboxamides as Anticancer Agents","year":2015,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Quinazolinone synthesis and applications","field":"Chemistry","cited_by":50,"is_retracted":false,"has_abstract":true,"ca_institutions":"Princess Margaret Cancer Centre; University Health Network","funders":"Basic Energy Sciences; Institute of Microbiology, Chinese Academy of Sciences; Canadian Institutes of Health Research; Office of Science; Princess Margaret Cancer Foundation; U.S. Department of Energy","keywords":"Chemistry; Indazole; In vivo; Pharmacology; Sulfonamide; Pharmacokinetics; Structure–activity relationship; IC50; Stereochemistry; In vitro; Biochemistry; Medicine","routes":{"ca_aff":true,"ca_fund":true,"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":[0.0008139861,0.0003099406,0.0005802035,0.00004054958,0.0001465232,0.00008583812,0.0007382975,0.000177445,0.0003585229],"category_scores_gemma":[0.0006392831,0.0002043877,0.0002543989,0.000222625,0.0004160576,0.0002632626,0.0001317983,0.000573139,0.00001437036],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001917155,"about_ca_system_score_gemma":0.0005661526,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005954378,"about_ca_topic_score_gemma":0.000004596743,"domain_scores_codex":[0.9969676,0.00002553749,0.001167445,0.0002593478,0.001169807,0.000410331],"domain_scores_gemma":[0.9970386,0.0002434352,0.001237307,0.0005645373,0.0005439611,0.0003721537],"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":[0.0004363757,0.0003588242,0.003007223,0.0002740264,0.0001962876,0.00007862367,0.0001748429,0.00003162169,0.980422,0.00005629053,0.01174034,0.003223535],"study_design_scores_gemma":[0.001554911,0.00009837548,0.0001922241,0.0007994752,0.0001994816,0.0002752833,0.001183881,0.00006528397,0.9685946,0.000596387,0.02621256,0.0002275211],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9818171,0.00481193,0.00006504608,0.001840143,0.0002117953,0.00006048342,0.00002732847,0.00001878698,0.01114738],"genre_scores_gemma":[0.9953927,0.000847301,0.0002418052,0.00009393952,0.001529649,0.00001032021,0.00001000198,0.00003878688,0.001835472],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01447222,"threshold_uncertainty_score":0.8334688,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02220381622919996,"score_gpt":0.2738940626766925,"score_spread":0.2516902464474925,"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."}}