{"id":"W3139057296","doi":"10.1021/acs.jmedchem.0c02023","title":"Tetrahydrofuran-Based Transient Receptor Potential Ankyrin 1 (TRPA1) Antagonists: Ligand-Based Discovery, Activity in a Rodent Asthma Model, and Mechanism-of-Action via Cryogenic Electron Microscopy","year":2021,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Ion Channels and Receptors","field":"Neuroscience","cited_by":49,"is_retracted":false,"has_abstract":true,"ca_institutions":"Paraza Pharma (Canada)","funders":"","keywords":"Chemistry; Transient receptor potential channel; Ankyrin; Biophysics; Mechanism of action; Ion channel; In vivo; Receptor; TRPV1; Pharmacology; Capsazepine; Biochemistry; In vitro","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000139839,0.0002473392,0.00017863,0.0001326141,0.00009984088,0.0001226105,0.0002821887,0.0002385831,0.0006507319],"category_scores_gemma":[0.0000710406,0.000101898,0.0001287722,0.00008575334,0.0001411943,0.0002260549,0.0001055637,0.0004048611,0.0002091456],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002216282,"about_ca_system_score_gemma":0.0001334555,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003941309,"about_ca_topic_score_gemma":0.001128672,"domain_scores_codex":[0.9999515,0.00001021593,0.000002179211,0.000008648309,0.00001285582,0.00001458109],"domain_scores_gemma":[0.9999725,0.000003218411,0.00001068712,0.000003159221,0.000005398869,0.000005009335],"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":[0.0000731387,0.00003625057,0.00003511667,0.00004093048,0.000003889161,0.0000405746,0.00001300536,0.0002337351,0.9970047,0.0001973288,0.00009244284,0.002228831],"study_design_scores_gemma":[0.00003927005,0.001384893,0.0008353228,0.00001002258,0.00001786594,0.0002185917,0.00001724499,0.001319391,0.9915387,0.0000907027,0.004520475,0.000007520152],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9748374,0.006472204,0.01326109,0.0003588011,0.00003533206,0.000184247,0.0007349302,0.000127359,0.003988682],"genre_scores_gemma":[0.9766906,0.007406247,0.01137587,0.0001421843,0.0000153649,0.00009106395,0.0005564431,0.00001754847,0.003704756],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0006507319,"threshold_uncertainty_score":0.00217694,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01475254281905854,"score_gpt":0.2769665336501954,"score_spread":0.2622139908311369,"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."}}