{"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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001160816,0.0003762435,0.0003693748,0.0001729344,0.00007577429,0.0003338018,0.0003177477,0.0001948016,0.0005694366],"category_scores_gemma":[0.00008400005,0.0001535317,0.0001828393,0.000197516,0.0001601865,0.0001936015,0.0001641548,0.0004176075,0.0002562081],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004719887,"about_ca_system_score_gemma":0.0003153314,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001019914,"about_ca_topic_score_gemma":0.002432996,"domain_scores_codex":[0.9999496,0.000006131119,0.000002643901,0.00001122972,0.00001475777,0.00001571381],"domain_scores_gemma":[0.9999722,0.000002782087,0.000009063312,0.000002304899,0.000005215116,0.000008429555],"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":[0.0002375915,0.000120481,0.0003689377,0.0001693355,0.00002391882,0.0001740205,0.00003187217,0.001919859,0.9742075,0.0008475243,0.0003164304,0.02158255],"study_design_scores_gemma":[0.0004128412,0.003799275,0.005124352,0.00003405409,0.000142277,0.0009826199,0.00004070998,0.007156007,0.9584148,0.0003140199,0.02354313,0.00003596753],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9673421,0.01336071,0.01317794,0.0002322025,0.00004683348,0.0001784182,0.0006509883,0.0002684799,0.004742214],"genre_scores_gemma":[0.9796206,0.01003348,0.006388656,0.00007224301,0.00002567859,0.00007407719,0.0007681184,0.00002563088,0.002991564],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001019914,"threshold_uncertainty_score":0.003424585,"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."}}