{"id":"W3194242155","doi":"10.21203/rs.3.rs-836915/v1","title":"Prediction of herb-drug interactions involving consumption of furanocoumarin-mixtures and cytochrome P450 1A2-mediated caffeine metabolism inhibition in humans","year":2021,"lang":"en","type":"preprint","venue":"Research Square","topic":"Synthesis and biological activity","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"King Abdullah International Medical Research Center; Simon Fraser University","keywords":"Furanocoumarin; Caffeine; Cytochrome P450; Pharmacology; Metabolism; Chemistry; Drug; Herb; Drug metabolism; Biochemistry; Biology; Traditional medicine; Medicine; Medicinal herbs; Endocrinology","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.001087793,0.0002512754,0.0006720242,0.0004015326,0.0001038655,0.00006677345,0.0001442168,0.0003836265,0.001131692],"category_scores_gemma":[0.001221636,0.0002193236,0.0001674024,0.0002691614,0.0003480933,0.0001687009,0.000734904,0.001504568,0.000002398362],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002183454,"about_ca_system_score_gemma":0.0001382523,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002409843,"about_ca_topic_score_gemma":0.00145018,"domain_scores_codex":[0.9972153,0.0005095915,0.0006561042,0.000628082,0.000653931,0.0003370226],"domain_scores_gemma":[0.9974646,0.001118666,0.0003089576,0.0004371776,0.0005684334,0.0001021852],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"observational","study_design_scores_codex":[0.0001513035,0.000558219,0.02831149,0.003844724,0.00009505823,0.00001970637,0.000640614,0.00003395316,0.9648236,0.00003854074,0.00004802437,0.001434779],"study_design_scores_gemma":[0.0006097354,0.00003747832,0.5155101,0.003914807,0.00004267069,0.000006748635,0.001151411,0.0005329706,0.4773882,0.0004790686,0.000120059,0.0002067069],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9952577,0.002856061,0.00001836516,0.0001197507,0.00005787627,0.0003806821,0.0007142313,0.00004400962,0.0005513247],"genre_scores_gemma":[0.9951754,0.00334856,0.00007570813,0.000003767898,0.0001518246,0.0001800137,0.0009569889,0.00002079375,0.00008693869],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.4874353,"threshold_uncertainty_score":0.9997814,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.09184548228678238,"score_gpt":0.3498423507514434,"score_spread":0.257996868464661,"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."}}