{"id":"W2054143423","doi":"10.1002/anie.201402750","title":"A Series of Potent CREBBP Bromodomain Ligands Reveals an Induced‐Fit Pocket Stabilized by a Cation–π Interaction","year":2014,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Protein Degradation and Inhibitors","field":"Biochemistry, Genetics and Molecular Biology","cited_by":115,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Ciência sem Fronteiras; Ministero dello Sviluppo Economico; Wellcome Trust; Ontario Ministry of Economic Development and Innovation; Engineering and Physical Sciences Research Council; Canadian Institutes of Health Research; Coordenação de Aperfeiçoamento de Pessoal de Nível Superior; Genome Canada; Pfizer; Eli Lilly and Company","keywords":"Bromodomain; Series (stratigraphy); Chemistry; Stereochemistry; Biochemistry; Biology; Epigenetics","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001246164,0.0003008799,0.0003158937,0.0001124003,0.000168088,0.000183368,0.0003857035,0.0001912835,0.001450554],"category_scores_gemma":[0.0000882329,0.0001267732,0.0001522718,0.00009710171,0.000178479,0.0001623149,0.0002062842,0.0003948362,0.0004524592],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003030647,"about_ca_system_score_gemma":0.0002024278,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005505778,"about_ca_topic_score_gemma":0.001034364,"domain_scores_codex":[0.9999422,0.000009255615,0.000002507683,0.00001055659,0.00001821978,0.00001721507],"domain_scores_gemma":[0.9999685,0.000006150866,0.000008001749,0.00000321446,0.000004939825,0.000009270337],"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":[0.0005300374,0.0001250886,0.0002710574,0.0001959802,0.00002133642,0.0001460221,0.00004451309,0.001804335,0.9832715,0.001252011,0.0004962447,0.01184188],"study_design_scores_gemma":[0.0005257141,0.004117798,0.002647412,0.00002386484,0.00005295847,0.0007079659,0.00003951519,0.004733891,0.9675166,0.0003753326,0.01920411,0.00005484117],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9826401,0.002718407,0.005957998,0.0002138099,0.00004477435,0.0001339299,0.0002675059,0.0002281843,0.007795255],"genre_scores_gemma":[0.9930304,0.001017374,0.002660311,0.00007747531,0.000006930197,0.00004348301,0.0002209848,0.00001152741,0.002931467],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001450554,"threshold_uncertainty_score":0.004852653,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01660790490270553,"score_gpt":0.2733271701713467,"score_spread":0.2567192652686411,"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."}}