{"id":"W2895673275","doi":"10.1002/anie.201810617","title":"Discovery of an MLLT1/3 YEATS Domain Chemical Probe","year":2018,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Protein Degradation and Inhibitors","field":"Biochemistry, Genetics and Molecular Biology","cited_by":95,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto; Ontario Institute for Cancer Research","funders":"UCB Pharma; Novartis Pharma; Ontario Ministry of Economic Development and Innovation; Ministero dello Sviluppo Economico; Genome Canada; Fundação de Amparo à Pesquisa do Estado de São Paulo; Diamond Light Source; Wellcome Trust; European Federation of Pharmaceutical Industries and Associations; Merck KGaA; Government of Ontario; Engineering and Physical Sciences Research Council; AstraZeneca; Pfizer","keywords":"Small molecule; Bromodomain; Chemical biology; Drug discovery; Chemistry; Epigenetics; Lysine; Computational biology; Biology; Biochemistry; Amino acid; Gene","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":[0.00009879093,0.00009320636,0.00007445298,0.0000383743,0.00002746844,0.00002464834,0.0001775788,0.0001074463,0.00009098815],"category_scores_gemma":[0.00007743416,0.00009001067,0.00005954977,0.00005003375,0.0001413328,0.00003711574,0.00006209355,0.00005016374,0.00001150819],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002355134,"about_ca_system_score_gemma":0.00003766898,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001055482,"about_ca_topic_score_gemma":0.000007515816,"domain_scores_codex":[0.9992785,0.00001345332,0.0001791438,0.000225212,0.0002026273,0.0001010635],"domain_scores_gemma":[0.9994891,0.000004490427,0.00009879308,0.0001707845,0.000196692,0.00004015996],"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":[0.00009397154,0.00009023939,0.0001171021,0.000005399267,0.00002485705,6.922568e-7,0.00003204853,1.843316e-7,0.9911299,0.0004168197,0.00761493,0.0004738051],"study_design_scores_gemma":[0.0003916467,0.0001427179,0.0002747959,0.00002013448,0.000004746803,0.0000101006,0.00003574958,0.000008647708,0.9782227,0.001079574,0.01970547,0.0001037651],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9774626,0.00003508477,0.01153783,0.0003614502,0.0008374228,0.0001189756,0.0000992798,0.00001760824,0.009529755],"genre_scores_gemma":[0.9922577,0.00001595539,0.001816975,0.0002492708,0.00336265,0.00002265575,0.001583977,0.00001254327,0.0006783178],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01479506,"threshold_uncertainty_score":0.3670529,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009069037906289514,"score_gpt":0.2604551088495594,"score_spread":0.2513860709432699,"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."}}