{"id":"W2011470741","doi":"10.1021/jm200648s","title":"Design, Synthesis, and Biological Evaluation of 3,4-Dihydroquinolin-2(1<i>H</i>)-one and 1,2,3,4-Tetrahydroquinoline-Based Selective Human Neuronal Nitric Oxide Synthase (nNOS) Inhibitors","year":2011,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Nitric Oxide and Endothelin Effects","field":"Medicine","cited_by":31,"is_retracted":false,"has_abstract":true,"ca_institutions":"NeurAxon (Canada)","funders":"National Institute of Neurological Disorders and Stroke","keywords":"Chemistry; Nitric oxide synthase; Pharmacology; Hyperalgesia; Neuropathic pain; Nitric oxide; Potency; Chemical synthesis; Amidine; Nociception; Anesthesia; Stereochemistry; Biochemistry; In vitro; Receptor; Medicine","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":[0.0002198827,0.0003301845,0.0003447643,0.0002458922,0.0001484019,0.0001888436,0.0004159547,0.0002555867,0.0009245626],"category_scores_gemma":[0.0001715194,0.0001400452,0.0002392768,0.0001696811,0.0001708567,0.0002168567,0.0001522505,0.0002449532,0.0002464466],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002158187,"about_ca_system_score_gemma":0.0003038676,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003880619,"about_ca_topic_score_gemma":0.0009557683,"domain_scores_codex":[0.999905,0.00002005686,0.00001136275,0.00002063089,0.00002456134,0.00001838565],"domain_scores_gemma":[0.9999315,0.000006915928,0.00001893269,0.000006453945,0.00001695019,0.00001927351],"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":[0.0002384835,0.0002700917,0.0001364426,0.0001918644,0.00001914852,0.0001563895,0.00003155718,0.001331251,0.9849116,0.0003720673,0.0001211853,0.01221995],"study_design_scores_gemma":[0.0004359988,0.008595295,0.002031374,0.00002224235,0.000086719,0.0004737543,0.00003026633,0.0014906,0.9772097,0.0001414853,0.009452964,0.00002953751],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9713245,0.009047859,0.01289374,0.0001956456,0.00008729219,0.0007788761,0.0007745609,0.0001149543,0.00478256],"genre_scores_gemma":[0.977401,0.00512316,0.01318427,0.0001366024,0.00002895944,0.0002115061,0.000859104,0.00001577467,0.00303948],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0009245626,"threshold_uncertainty_score":0.003092945,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.07997330475467632,"score_gpt":0.2943170052039891,"score_spread":0.2143437004493128,"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."}}