{"id":"W2036442353","doi":"10.1016/j.ejmech.2014.07.018","title":"Towards the development of chromone-based MEK1/2 modulators","year":2014,"lang":"en","type":"article","venue":"European Journal of Medicinal Chemistry","topic":"Melanoma and MAPK Pathways","field":"Biochemistry, Genetics and Molecular Biology","cited_by":16,"is_retracted":false,"has_abstract":false,"ca_institutions":"Université de Montréal; Institute for Research in Immunology and Cancer","funders":"Vetenskapsrådet; Knut och Alice Wallenbergs Stiftelse; Svenska Forskningsrådet Formas; Cancer Research Society","keywords":"Chromone; Chemistry; Allosteric regulation; Kinase; Structure–activity relationship; In vitro; Lead compound; Protein kinase A; IC50; MAPK/ERK pathway; Drug discovery; Biochemistry; Stereochemistry; Enzyme","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":[0.0003633411,0.00056636,0.0002588066,0.0003241601,0.0002135951,0.0004451669,0.0005321699,0.0003752414,0.003251803],"category_scores_gemma":[0.0001941961,0.000184872,0.0002164365,0.0001965059,0.0003144032,0.0005787803,0.0004983409,0.001059539,0.0007465008],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005023822,"about_ca_system_score_gemma":0.0004828557,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006048667,"about_ca_topic_score_gemma":0.002100528,"domain_scores_codex":[0.9999344,0.00001277457,0.000003334729,0.00001290346,0.00001454934,0.0000220362],"domain_scores_gemma":[0.9999487,0.000009445188,0.00001026339,0.000004453649,0.00001075666,0.0000163997],"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":[0.001273498,0.0007883376,0.000624324,0.001953133,0.0001082744,0.001007724,0.0003542283,0.006830468,0.7873726,0.03199204,0.006905134,0.1607902],"study_design_scores_gemma":[0.0007407422,0.005483069,0.002439121,0.0003447949,0.0001697913,0.00131734,0.0001492939,0.008232314,0.7899519,0.007245805,0.1838036,0.0001223391],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6722018,0.1205424,0.1335755,0.004504906,0.001303684,0.001305164,0.001899672,0.001226341,0.06344058],"genre_scores_gemma":[0.904594,0.05325669,0.02248117,0.001253476,0.0001421726,0.0002760459,0.0007978134,0.00004678756,0.01715189],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003251803,"threshold_uncertainty_score":0.01087832,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01459600227480177,"score_gpt":0.218712138683018,"score_spread":0.2041161364082163,"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."}}