{"id":"W4402274272","doi":"10.1021/acsmedchemlett.4c00293","title":"Design, Synthesis, and Structural Evaluation of Acetylated Phenylthioketone Inhibitors of HDAC10","year":2024,"lang":"en","type":"article","venue":"ACS Medicinal Chemistry Letters","topic":"Histone Deacetylase Inhibitors Research","field":"Biochemistry, Genetics and Molecular Biology","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Brookhaven National Laboratory; Biological and Environmental Research; Division of Chemistry; Office of Science; National Institute of General Medical Sciences; Vagelos Institute for Energy Science and Technology, University of Pennsylvania; Beef Cattle Research Council; University of Pennsylvania; U.S. Department of Energy; National Institutes of Health; National Science Foundation","keywords":"Acetylation; Computer science; Engineering ethics; Medicine; Combinatorial chemistry; Chemistry; Biochemistry; Engineering","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":[0.0002826405,0.0005228773,0.000396394,0.000233015,0.0001584625,0.0002744079,0.0005739179,0.0002929709,0.001170412],"category_scores_gemma":[0.0002059809,0.0002470696,0.0003244885,0.0002282434,0.000200599,0.0001947108,0.0001908907,0.0005648551,0.000413919],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005786063,"about_ca_system_score_gemma":0.0003878022,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001176921,"about_ca_topic_score_gemma":0.003105334,"domain_scores_codex":[0.9998691,0.00002176412,0.0000157028,0.00001975724,0.00004060725,0.00003302524],"domain_scores_gemma":[0.9998922,0.00001179401,0.00002789395,0.000008659664,0.00002613212,0.00003331144],"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":[0.0002899433,0.0001759969,0.0001707274,0.0001348195,0.00003973623,0.0001307098,0.00003494522,0.001961717,0.9907603,0.0003141557,0.0001892242,0.005797659],"study_design_scores_gemma":[0.0002200051,0.002426282,0.0007544016,0.00001107832,0.00006234412,0.0002298748,0.00002380258,0.001960514,0.9886457,0.00004530935,0.005600876,0.00001985499],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9693132,0.004986278,0.01693635,0.0002529261,0.00009550372,0.0007423285,0.0011012,0.0001877056,0.006384429],"genre_scores_gemma":[0.9692833,0.006014365,0.01837211,0.0001372496,0.00002500937,0.000255487,0.001159348,0.00004600076,0.004707137],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001176921,"threshold_uncertainty_score":0.004198134,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01926049140520217,"score_gpt":0.2987359585570099,"score_spread":0.2794754671518077,"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."}}