{"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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001301976,0.000374739,0.000331213,0.0002336087,0.000134624,0.0002605123,0.000346701,0.0003052666,0.001491455],"category_scores_gemma":[0.0001268074,0.0001331642,0.0002303112,0.0001569967,0.0001334498,0.0001692395,0.0001997672,0.0005251977,0.0005886565],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002550407,"about_ca_system_score_gemma":0.0002384933,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004814792,"about_ca_topic_score_gemma":0.00106108,"domain_scores_codex":[0.9999434,0.000005927154,0.00000278124,0.00001411189,0.00001475485,0.00001902345],"domain_scores_gemma":[0.9999621,0.000005922248,0.000006654195,0.000003930152,0.000007611891,0.0000137402],"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":[0.0002447969,0.0002116407,0.0003353865,0.0001192319,0.00003274048,0.000176038,0.00003537538,0.001285893,0.973504,0.0007825632,0.0008757107,0.02239668],"study_design_scores_gemma":[0.0002668993,0.002882612,0.001528134,0.0000192708,0.00007751141,0.0006394472,0.00002035219,0.003778057,0.9735564,0.000204412,0.01700668,0.00002013597],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9324064,0.009197053,0.03947279,0.0006482613,0.0001527168,0.000509128,0.001887953,0.0008117551,0.01491403],"genre_scores_gemma":[0.9734651,0.005075897,0.01115282,0.0003573322,0.0000301574,0.0001194965,0.001517258,0.00004560598,0.00823632],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001491455,"threshold_uncertainty_score":0.004989445,"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."}}