{"id":"W1989616545","doi":"10.1016/j.bmcl.2012.02.004","title":"Novel, druglike 1,7-disubstituted 2,3,4,5-tetrahydro-1H-benzo[b]azepine-based selective inhibitors of human neuronal nitric oxide synthase (nNOS)","year":2012,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Nitric Oxide and Endothelin Effects","field":"Medicine","cited_by":8,"is_retracted":false,"has_abstract":false,"ca_institutions":"NeurAxon (Canada)","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Azepine; Chemistry; hERG; Nitric oxide synthase; Nitric oxide; In vivo; Pharmacology; In vitro; Stereochemistry; Biochemistry; Potassium channel; Biophysics","routes":{"ca_aff":true,"ca_fund":true,"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":[0.0001013279,0.0002761334,0.0003012539,0.0001428963,0.0001260695,0.0001868431,0.0004827655,0.0001738023,0.001686164],"category_scores_gemma":[0.00008883518,0.0001034815,0.0001152078,0.0001176312,0.0001643863,0.0002099487,0.0001428244,0.0004289206,0.0005298768],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002803376,"about_ca_system_score_gemma":0.0001761415,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003800751,"about_ca_topic_score_gemma":0.001686796,"domain_scores_codex":[0.9999424,0.000009359245,0.000003772875,0.0000126524,0.00001228019,0.00001944366],"domain_scores_gemma":[0.9999719,0.00000435303,0.000007809514,0.000002406563,0.000004157923,0.000009328582],"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":[0.0002945154,0.0001320624,0.0001519779,0.0001418705,0.00001215871,0.0001385632,0.00004464337,0.0003377605,0.9855374,0.0008714081,0.0006013814,0.01173639],"study_design_scores_gemma":[0.0003752011,0.002855703,0.004525152,0.00002150506,0.00005711357,0.001090967,0.00004448221,0.002226879,0.967712,0.0003642483,0.02069915,0.00002766271],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9522343,0.01672544,0.01176275,0.0004146075,0.0003925803,0.0002102241,0.00158251,0.0003577392,0.01631984],"genre_scores_gemma":[0.9767288,0.007275299,0.005816205,0.0002695029,0.00006520616,0.0001047077,0.001069068,0.00002339151,0.008647842],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001686164,"threshold_uncertainty_score":0.005640745,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0143129999694495,"score_gpt":0.251778795082498,"score_spread":0.2374657951130484,"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."}}