{"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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004279802,0.0002488469,0.0004819689,0.0001101746,0.00009441033,0.00004564653,0.000190522,0.0001864054,0.00005651748],"category_scores_gemma":[0.0001265207,0.0002111088,0.0002178482,0.0002999879,0.0001489088,0.0002180834,0.00002083697,0.0006750656,5.178445e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002406141,"about_ca_system_score_gemma":0.0006405879,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001899141,"about_ca_topic_score_gemma":0.000007285932,"domain_scores_codex":[0.9977953,0.0001146571,0.0006014401,0.0003747361,0.0007633235,0.0003504868],"domain_scores_gemma":[0.9989704,0.00009284967,0.000490115,0.0001337469,0.0001191029,0.0001938125],"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":[0.001192831,0.0004964925,0.00002131352,0.0002666658,0.00001298668,0.0001423576,0.0000993037,0.005475644,0.9917436,0.000002186134,0.00004016632,0.0005064855],"study_design_scores_gemma":[0.002411201,0.0003696693,0.00003594958,0.0003247829,0.00004313418,0.0003391055,0.0001223546,0.02963305,0.9664291,0.00005680515,0.00004775312,0.0001871647],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9763252,0.0002857367,0.02154735,0.001154611,0.000535791,0.000097364,0.00002399386,0.000009392837,0.00002055755],"genre_scores_gemma":[0.9988651,0.0003359621,0.0003214237,0.0001309692,0.0002375801,0.000003673881,0.000005278945,0.00002385217,0.00007618163],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02531454,"threshold_uncertainty_score":0.8608769,"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."}}