{"id":"W2331294555","doi":"10.1021/acs.jmedchem.5b01772","title":"Discovery of a Potent Class I Protein Arginine Methyltransferase Fragment Inhibitor","year":2016,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Cancer-related gene regulation","field":"Biochemistry, Genetics and Molecular Biology","cited_by":35,"is_retracted":false,"has_abstract":true,"ca_institutions":"Princess Margaret Cancer Centre; Structural Genomics Consortium; University of Toronto","funders":"Structural Genomics Consortium; Wellcome Trust; Wellcome","keywords":"Methyltransferase; Chemistry; Methylation; Arginine; Protein arginine methyltransferase 5; Biochemistry; Small molecule; Enzyme; Ligand (biochemistry); Drug discovery; Computational biology; Amino acid; Biology; Receptor; DNA","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":[0.0003596029,0.0001434024,0.0002551313,0.00003521286,0.00001852049,0.000005536661,0.0001589917,0.0001686427,0.00003229524],"category_scores_gemma":[0.000156168,0.00009293571,0.0001791088,0.00006876044,0.0001199179,0.00001077201,0.00003077611,0.0001446557,7.259804e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007513945,"about_ca_system_score_gemma":0.0002715326,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000003070558,"about_ca_topic_score_gemma":0.000001224816,"domain_scores_codex":[0.9986597,0.00003273597,0.0005531088,0.0001618887,0.0004318549,0.0001606978],"domain_scores_gemma":[0.99905,0.00001697488,0.0003950862,0.0002089129,0.0002184484,0.0001105896],"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":[0.0006650796,0.00008855366,0.0001160287,0.00009198939,0.0001263117,0.00001424657,0.0000199574,0.0000325989,0.9911098,0.000005749821,0.0009776653,0.006752058],"study_design_scores_gemma":[0.002032587,0.000505837,0.0002908383,0.0005459494,0.000068297,0.0001709083,0.00006380518,0.000003820253,0.9904768,0.00004652929,0.005684186,0.0001104091],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9903886,0.001887387,0.005418037,0.001702611,0.0001741743,0.0001007012,0.00001652196,0.000002447873,0.0003094902],"genre_scores_gemma":[0.9973015,0.0002701686,0.0002981923,0.00003477074,0.001216478,0.000004662052,0.000007907419,0.00001625563,0.0008500845],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00691285,"threshold_uncertainty_score":0.3789808,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.005281429128752593,"score_gpt":0.2292070040630772,"score_spread":0.2239255749343246,"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."}}