{"id":"W4301503045","doi":"10.1016/j.ejmcr.2022.100075","title":"Design, synthesis and structure-activity relationship studies of 3-phenylpyrazino[1,2-a]indol-1(2H)-ones as amyloid aggregation and cholinesterase inhibitors with antioxidant activity","year":2022,"lang":"en","type":"article","venue":"European Journal of Medicinal Chemistry Reports","topic":"Cholinesterase and Neurodegenerative Diseases","field":"Medicine","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Waterloo","funders":"Faculty of Science, Prince of Songkla University; Natural Sciences and Engineering Research Council of Canada; Government of Ontario; University of Waterloo; Canada Foundation for Innovation; Ontario Research Foundation","keywords":"Butyrylcholinesterase; Chemistry; Cholinesterase; IC50; Antioxidant; Acetylcholinesterase; Cytotoxicity; Pharmacology; Biochemistry; Aché; Viability assay; Enzyme; In vitro; Biology","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":[0.00009732677,0.0002943206,0.0002280726,0.0001448377,0.00008066261,0.0001740567,0.0002955243,0.0001563232,0.0006988269],"category_scores_gemma":[0.00008029792,0.0001232314,0.0001857436,0.0001644299,0.0001048819,0.000158185,0.00009939365,0.0002332793,0.0002268287],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001847322,"about_ca_system_score_gemma":0.0002097163,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000335159,"about_ca_topic_score_gemma":0.0007986265,"domain_scores_codex":[0.9999626,0.000005608048,0.000003457596,0.000008398828,0.00001007664,0.000009821436],"domain_scores_gemma":[0.999953,0.000004585001,0.00001773172,0.000003781633,0.000009733803,0.00001105671],"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":[0.0001991295,0.0001777063,0.0002523337,0.0001898949,0.00001555042,0.0001690117,0.00003320337,0.001847358,0.988519,0.0002357329,0.00008067378,0.008280284],"study_design_scores_gemma":[0.0001444878,0.005285447,0.003857203,0.00001451094,0.00006621692,0.0005176847,0.00002626535,0.0026087,0.9818386,0.00008000535,0.005536267,0.00002466888],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9870059,0.005696292,0.004207961,0.00009580219,0.00001911895,0.0001839519,0.0004147891,0.00007366932,0.002302548],"genre_scores_gemma":[0.9873999,0.003994447,0.005825757,0.00005958472,0.0000103513,0.00007614805,0.0006029102,0.000007879384,0.002022914],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0006988269,"threshold_uncertainty_score":0.002337813,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04097232537245905,"score_gpt":0.2913969154018993,"score_spread":0.2504245900294402,"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."}}