{"id":"W2788587956","doi":"10.1021/acs.jmedchem.7b01574","title":"Selective Inhibitors of Human Neuraminidase 3","year":2018,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Glycosylation and Glycoproteins Research","field":"Biochemistry, Genetics and Molecular Biology","cited_by":66,"is_retracted":false,"has_abstract":true,"ca_institutions":"Alberta Glycomics Centre; Université de Montréal; University of Alberta","funders":"Canadian Glycomics Network; Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Neuraminidase; Isozyme; In vitro; Small molecule; Biochemistry; Selectivity; Enzyme; Sialic acid; Structure–activity relationship; Combinatorial chemistry; Stereochemistry","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":[0.0002019657,0.0006336119,0.0004917854,0.0002789808,0.0001635693,0.0002233868,0.0002982501,0.00020955,0.001054455],"category_scores_gemma":[0.0001297916,0.0001572705,0.0002931956,0.0002667402,0.0001320555,0.0001933816,0.000267739,0.0004468405,0.0005198866],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004364095,"about_ca_system_score_gemma":0.0002717698,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006497588,"about_ca_topic_score_gemma":0.001462089,"domain_scores_codex":[0.9998581,0.00002387169,0.0000125144,0.00002740392,0.0000358482,0.0000421981],"domain_scores_gemma":[0.9999516,0.000008343022,0.000009050316,0.000004761887,0.00001309583,0.00001306732],"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":[0.0002686819,0.0001195109,0.0002220054,0.0001810787,0.0000304364,0.0001222177,0.0000324391,0.0008348952,0.9815823,0.0003757066,0.0004117754,0.01581891],"study_design_scores_gemma":[0.0001011205,0.0009462928,0.0009235291,0.00001762714,0.00004731703,0.0003991769,0.0000114733,0.0008974289,0.9865471,0.00007659276,0.01001945,0.00001283831],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9350485,0.02917116,0.02023732,0.0002915275,0.000137216,0.0004125735,0.001952771,0.0002819363,0.0124671],"genre_scores_gemma":[0.9557861,0.02020219,0.01321256,0.0002646553,0.0000415886,0.0002575245,0.001759257,0.00005161357,0.008424528],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001054455,"threshold_uncertainty_score":0.003527522,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01173054636966186,"score_gpt":0.3113129890512552,"score_spread":0.2995824426815933,"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."}}