{"id":"W4402786738","doi":"10.1002/cmdc.202400598","title":"Synthesis and Structure‐Activity Relationship Analysis of 2‐Substituted‐1,2,4‐Triazolo[1,5‐a]Pyrimidin‐7‐Ones and their 6‐Carboxylate Derivatives as Xanthine Oxidase Inhibitors","year":2024,"lang":"en","type":"article","venue":"ChemMedChem","topic":"Gout, Hyperuricemia, Uric Acid","field":"Medicine","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"Bentley (Canada)","funders":"","keywords":"Xanthine oxidase; Chemistry; Carboxylate; Stereochemistry; Xanthine; Combinatorial chemistry; Biochemistry; Enzyme","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":[0.0001765833,0.0005628963,0.0006645116,0.0004447588,0.0001942837,0.0002941682,0.0004169968,0.000314138,0.002644085],"category_scores_gemma":[0.0001887496,0.0002235491,0.0003914803,0.0005911235,0.0001284855,0.000261157,0.000252789,0.0004226795,0.0006387794],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000276526,"about_ca_system_score_gemma":0.0003919657,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006421935,"about_ca_topic_score_gemma":0.001497921,"domain_scores_codex":[0.9999019,0.00001474065,0.0000110218,0.0000208587,0.00002661637,0.00002490343],"domain_scores_gemma":[0.9999235,0.000008605482,0.00001987461,0.000006272281,0.00001836102,0.00002332877],"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":[0.0009789522,0.001137071,0.0006356997,0.002153811,0.0001573942,0.0009715956,0.0001415055,0.01222419,0.92149,0.001908666,0.001776008,0.05642506],"study_design_scores_gemma":[0.00112797,0.017783,0.007944185,0.0001862277,0.0004342793,0.001239506,0.0001182624,0.01349631,0.8920286,0.0005131987,0.06493237,0.0001961214],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9240881,0.04692918,0.01065287,0.0003468168,0.000214606,0.0008980323,0.003117936,0.0002812899,0.01347126],"genre_scores_gemma":[0.9631475,0.01818739,0.008980684,0.0001599774,0.00003087659,0.0003144407,0.002472521,0.00002493238,0.006681612],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002644085,"threshold_uncertainty_score":0.008845389,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.021575005237253,"score_gpt":0.2706013801620809,"score_spread":0.2490263749248279,"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."}}