{"id":"W2902476519","doi":"10.1021/acs.jmedchem.8b01621","title":"Identification of Selective Acyl Sulfonamide–Cycloalkylether Inhibitors of the Voltage-Gated Sodium Channel (Na <sub>V</sub> ) 1.7 with Potent Analgesic Activity","year":2018,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Ion channel regulation and function","field":"Biochemistry, Genetics and Molecular Biology","cited_by":35,"is_retracted":false,"has_abstract":true,"ca_institutions":"Xenon Pharmaceuticals (Canada)","funders":"","keywords":"Chemistry; Potency; Sodium channel; Sulfonamide; Pharmacology; Pharmacokinetics; Metabolic stability; Nav1.5; In vivo; Docking (animal); Lead compound; Analgesic; Drug discovery; Combinatorial chemistry; Stereochemistry; Biochemistry; In vitro; Sodium","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":[0.0004830829,0.0001421052,0.0002210039,0.00004627502,0.00006837349,0.000006149694,0.0001769196,0.0001663775,0.000009290126],"category_scores_gemma":[0.0001862717,0.00009426381,0.0001357095,0.0002396533,0.0003147821,0.00001240616,0.00003844996,0.0002084406,5.633516e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005077687,"about_ca_system_score_gemma":0.0002074439,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000006801133,"about_ca_topic_score_gemma":0.000003535426,"domain_scores_codex":[0.9987261,0.00005181201,0.0004492154,0.0001662151,0.0004667551,0.000139931],"domain_scores_gemma":[0.9976629,0.00001630412,0.001082317,0.0002123522,0.0009493972,0.00007671016],"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":[0.0008614993,0.0001133434,0.0007350689,0.00006272499,0.0001195881,0.000001425661,0.0001210868,0.0001131474,0.9952893,9.393686e-7,0.0007876383,0.001794203],"study_design_scores_gemma":[0.0008633329,0.000421622,0.01118367,0.0001179168,0.00008548201,0.00009940042,0.0002580807,0.0003403838,0.9863515,0.00002962734,0.0001578755,0.0000911009],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.99448,0.0001220836,0.004480556,0.0002910659,0.0003530619,0.00009285378,0.000006825903,0.00000305944,0.0001704657],"genre_scores_gemma":[0.9987371,0.00003975804,0.0000106914,0.00004154568,0.0009983577,0.000001696782,0.000007330941,0.00001522284,0.0001482954],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0104486,"threshold_uncertainty_score":0.3843967,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006078781025396858,"score_gpt":0.2193583373972671,"score_spread":0.2132795563718703,"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."}}