{"id":"W2253015953","doi":"10.1021/ml3000534","title":"Design and Synthesis of Potent, Selective Inhibitors of Matriptase","year":2012,"lang":"en","type":"article","venue":"ACS Medicinal Chemistry Letters","topic":"Protein Kinase Regulation and GTPase Signaling","field":"Biochemistry, Genetics and Molecular Biology","cited_by":72,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Sherbrooke","funders":"Canadian Institutes of Health Research","keywords":"Proteases; Serine protease; Benzothiazole; Serine; Chemistry; Transmembrane protein; Enzyme; Biochemistry; Protease; Computational biology; Cancer research; Biology; Receptor","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":[0.0003137793,0.000112831,0.0001588506,0.00002318012,0.00002571352,0.0000021107,0.00007341341,0.00009088697,0.000008346017],"category_scores_gemma":[0.000208648,0.0001048812,0.00004186159,0.00007329716,0.000158423,0.000004684925,0.00003863478,0.00006390544,3.795525e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001042042,"about_ca_system_score_gemma":0.0000299596,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001167429,"about_ca_topic_score_gemma":6.304689e-8,"domain_scores_codex":[0.9992795,0.00004409337,0.0002069617,0.0001474798,0.0001517962,0.0001701508],"domain_scores_gemma":[0.9994145,0.00003389725,0.0002584289,0.0001488965,0.00004896191,0.00009530372],"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":[0.00009080184,0.00004013512,0.001401806,0.0001359184,0.00004705953,0.000001661233,0.00006040686,0.000023228,0.9963859,0.000002345919,0.0007147979,0.001095965],"study_design_scores_gemma":[0.0002936835,0.00002750742,0.000417917,0.00006498725,0.000053016,0.00003299856,0.00007965363,0.00001618135,0.9987071,0.00000530256,0.000203289,0.0000984304],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.99365,0.001504007,0.004327595,0.0002357113,0.00002953958,0.000105503,0.000006555429,0.000005078632,0.0001360617],"genre_scores_gemma":[0.9981425,0.00004706315,0.001426526,0.0001292101,0.0002027005,0.00001127895,0.00001578451,0.0000113058,0.00001367146],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004492512,"threshold_uncertainty_score":0.427693,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008741691612516016,"score_gpt":0.2242935361385023,"score_spread":0.2155518445259863,"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."}}