{"id":"W2608441731","doi":"10.1039/c7ra02889j","title":"Application of quinazoline and pyrido[3,2-d]pyrimidine templates to design multi-targeting agents in Alzheimer's disease","year":2017,"lang":"en","type":"article","venue":"RSC Advances","topic":"Cholinesterase and Neurodegenerative Diseases","field":"Medicine","cited_by":28,"is_retracted":false,"has_abstract":true,"ca_institutions":"Regional Municipality of Waterloo; University of Waterloo","funders":"Natural Sciences and Engineering Research Council of Canada; University of Waterloo; Universities Space Research Association; Government of Ontario","keywords":"Quinazoline; Pyrimidine; Combinatorial chemistry; Disease; Template; Alzheimer's disease; Chemistry; Medicine; Computer science; Computer architecture; Pharmacology; Stereochemistry; Programming language; Internal medicine","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001019442,0.000134513,0.0002422592,0.00007902676,0.0001137215,0.000018808,0.00009562568,0.00002155636,0.000006804524],"category_scores_gemma":[0.0003819405,0.0001144023,0.00003419949,0.00006074839,0.0000672032,0.0002347361,0.00005776268,0.00005195718,0.000005226418],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001022919,"about_ca_system_score_gemma":0.00002774483,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003741588,"about_ca_topic_score_gemma":0.00001969726,"domain_scores_codex":[0.9991631,0.0000288266,0.0002373889,0.0002943033,0.0001246383,0.0001517271],"domain_scores_gemma":[0.999212,0.00006550852,0.0001439094,0.0002973512,0.00007837273,0.0002028563],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"observational","study_design_gemma":"observational","study_design_scores_codex":[0.001537506,0.0007296466,0.8787487,0.0002111621,0.00004807738,0.00008596247,0.0002781783,0.001932715,0.0735111,0.00004590366,0.0001736599,0.04269737],"study_design_scores_gemma":[0.00238909,0.0001759788,0.8559064,0.0002499459,0.0001728376,0.000003688675,0.00007566156,0.01167979,0.1269887,0.0001006573,0.002024372,0.0002329336],"study_design_candidate":"observational","study_design_consensus":"observational","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9875171,0.007787023,0.003355491,0.0005802884,0.00005012143,0.000641422,0.00002999363,0.00002015401,0.0000183606],"genre_scores_gemma":[0.9953904,0.0006576179,0.00346573,0.0002490114,0.00010203,0.00007051934,0.00003141035,0.00001615369,0.0000171218],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05347759,"threshold_uncertainty_score":0.466519,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.08703231357930599,"score_gpt":0.3841154990860277,"score_spread":0.2970831855067217,"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."}}