{"id":"W4393217486","doi":"10.1021/acs.jnatprod.3c00942","title":"Transient Receptor Potential Melastatin 7 (TRPM7) Ion Channel Inhibitors: Preliminary SAR and Conformational Studies of Xenicane Diterpenoids from the Hawaiian Soft Coral <i>Sarcothelia edmondsoni</i>","year":2024,"lang":"en","type":"article","venue":"Journal of Natural Products","topic":"Magnesium in Health and Disease","field":"Nursing","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto; BC Children's Hospital; University of British Columbia","funders":"National Center for Complementary and Integrative Health; National Institute of General Medical Sciences; National Institute of Neurological Disorders and Stroke; American Society of Pharmacognosy","keywords":"Pharmacophore; Stereochemistry; Chemistry; Ion channel; Structure–activity relationship; Biochemistry; Receptor; In vitro","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006260556,0.0002151642,0.0003589455,0.0001339892,0.0001831393,0.00008437497,0.0001907711,0.00007360186,0.00002559101],"category_scores_gemma":[0.0005654634,0.0001343168,0.0001275733,0.0002350459,0.0002404537,0.0006167426,0.00004817552,0.0005604079,0.000006159242],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007476164,"about_ca_system_score_gemma":0.0002102118,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004005155,"about_ca_topic_score_gemma":0.000003524695,"domain_scores_codex":[0.9978094,0.0001804253,0.0008608715,0.0002336534,0.0006404875,0.0002752374],"domain_scores_gemma":[0.998351,0.0003501214,0.0004272982,0.0001588354,0.0005596531,0.0001530257],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.03704223,0.001045088,0.0008159216,0.01161671,0.0007527101,0.0002876275,0.06031394,0.000791123,0.2986775,0.0002982252,0.4220962,0.1662627],"study_design_scores_gemma":[0.02716228,0.02877419,0.09029876,0.01626851,0.006275745,0.003464221,0.05157402,0.02753866,0.5910733,0.01664796,0.1362491,0.004673262],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8777592,0.07402881,0.000016438,0.03904844,0.008529658,0.0003900121,0.0001895324,0.00002329192,0.00001459201],"genre_scores_gemma":[0.9956309,0.0002028717,0.0005895603,0.000611564,0.002831094,0.0000028309,0.00003821549,0.00002057838,0.00007235484],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2923957,"threshold_uncertainty_score":0.5477279,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01602301439221259,"score_gpt":0.2789431665342368,"score_spread":0.2629201521420242,"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."}}