{"id":"W2963503058","doi":"10.1172/jci120633","title":"Structure-guided drug design identifies a BRD4-selective small molecule that suppresses HIV","year":2019,"lang":"en","type":"article","venue":"Journal of Clinical Investigation","topic":"HIV Research and Treatment","field":"Immunology and Microbiology","cited_by":84,"is_retracted":false,"has_abstract":true,"ca_institutions":"Institute of Infection and Immunity","funders":"National Institute of Allergy and Infectious Diseases; Lanzhou Veterinary Research Institute, Chinese Academy of Agricultural Sciences; National Institutes of Health; Chinese Academy of Agricultural Sciences; China Scholarship Council; National Institute of Mental Health; Robert Mapplethorpe Foundation; Crohn's and Colitis Foundation; U.S. Department of Defense","keywords":"Bromodomain; BRD4; Epigenetics; Chromatin; Provirus; Biology; Histone; BET inhibitor; Transactivation; Small molecule; Drug discovery; Virology; Transcription factor; Genetics; Bioinformatics; Genome; DNA","routes":{"ca_aff":true,"ca_fund":false,"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":[0.001220947,0.0001468521,0.0004812387,0.0001305739,0.00008273828,0.00004661673,0.0002539937,0.0002107516,0.0005150108],"category_scores_gemma":[0.001480516,0.000105596,0.0002108241,0.0001193362,0.0002662513,0.0002371695,0.00004783168,0.0006469501,0.0005825924],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004202201,"about_ca_system_score_gemma":0.0003977102,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002902755,"about_ca_topic_score_gemma":0.00002003318,"domain_scores_codex":[0.9974107,0.001116475,0.000889627,0.0002077738,0.0001191516,0.0002562939],"domain_scores_gemma":[0.997256,0.001376806,0.0007046111,0.0001917756,0.000370218,0.0001005833],"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":[0.001527849,0.0004400245,0.3356328,0.00007794892,0.001901296,0.00008737566,0.001312109,0.0003795064,0.5065643,0.0004422867,0.1490932,0.002541252],"study_design_scores_gemma":[0.00418077,0.0008297359,0.1065247,0.0001294991,0.000139867,0.000150432,0.0001796857,0.00002977454,0.8785181,0.007314515,0.001829245,0.0001736528],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9962096,0.0007724307,0.0005567066,0.001067185,0.0008254066,0.0003003506,0.0000225466,0.00001517612,0.000230561],"genre_scores_gemma":[0.9957289,0.0001165098,0.001241401,0.0002341845,0.00009481991,0.000003662517,0.00005775497,0.00001313224,0.002509688],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.3719538,"threshold_uncertainty_score":0.7488242,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.09694265488467114,"score_gpt":0.3596081667909881,"score_spread":0.262665511906317,"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."}}