{"id":"W2328352462","doi":"10.1021/jm5005336","title":"The Discovery of Polo-Like Kinase 4 Inhibitors: Identification of (1<i>R</i>,2<i>S</i>)-2-(3-((<i>E</i>)-4-(((<i>cis</i>)-2,6-Dimethylmorpholino)methyl)styryl)-1<i>H</i>-indazol-6-yl)-5′-methoxyspiro[cyclopropane-1,3′-indolin]-2′-one (CFI-400945) as a Potent, Orally Active Antitumor Agent","year":2014,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Microtubule and mitosis dynamics","field":"Biochemistry, Genetics and Molecular Biology","cited_by":171,"is_retracted":false,"has_abstract":true,"ca_institutions":"Princess Margaret Cancer Centre; University Health Network","funders":"SLAC National Accelerator Laboratory","keywords":"Chemistry; Kinase; Cyclopropane; Stereochemistry; Polo-like kinase; Protein kinase domain; Biochemistry; Cell cycle; Apoptosis","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000142397,0.0005609593,0.0004722103,0.0001762736,0.0001617052,0.0005252571,0.0005304622,0.0003721426,0.00127877],"category_scores_gemma":[0.0001893401,0.0002078409,0.0004501325,0.0002085852,0.000220078,0.0004251958,0.0002908863,0.0005839933,0.0002723233],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005967188,"about_ca_system_score_gemma":0.000992746,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001727538,"about_ca_topic_score_gemma":0.003057738,"domain_scores_codex":[0.9999585,0.000005587194,0.000001577431,0.00001018329,0.00001376457,0.00001044804],"domain_scores_gemma":[0.9999707,0.000007267759,0.00000913285,0.000001552131,0.000004029704,0.000007238416],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001344355,0.0007039364,0.003440055,0.00151014,0.0002232886,0.001456322,0.0001144689,0.6472465,0.2340853,0.02643625,0.004010934,0.07942829],"study_design_scores_gemma":[0.001426445,0.003404243,0.001856978,0.0001071148,0.0004105919,0.0006102985,0.0001617707,0.8132466,0.1391028,0.00637213,0.03321156,0.00008949491],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9405312,0.009568216,0.03029151,0.001017543,0.0001308282,0.0002428422,0.001186006,0.0005510338,0.01648084],"genre_scores_gemma":[0.9723937,0.006196097,0.01670793,0.0001553772,0.00001554378,0.000169123,0.001036171,0.00003470871,0.003291393],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001727538,"threshold_uncertainty_score":0.004329503,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006331205123937271,"score_gpt":0.2445910552117513,"score_spread":0.238259850087814,"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."}}