{"id":"W4282574367","doi":"10.1021/acs.jmedchem.1c02226","title":"Rationally Designed Amanitins Achieve Enhanced Cytotoxicity","year":2022,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Silymarin and Mushroom Poisoning","field":"Medicine","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of British Columbia","funders":"Canadian Cancer Society Research Institute; Canadian Institutes of Health Research","keywords":"Cytotoxicity; Chemistry; Cytotoxic T cell; HeLa; Natural product; HEK 293 cells; Peptide; Structure–activity relationship; Combinatorial chemistry; In vitro; Biochemistry; Stereochemistry; Gene","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":[0.000235617,0.0004113081,0.0003017862,0.0001724564,0.0001599075,0.0004602495,0.000242234,0.0003489017,0.001074723],"category_scores_gemma":[0.0002500983,0.0001495678,0.0001855676,0.0001438468,0.0002399237,0.000330868,0.0003257056,0.0006106165,0.0005401251],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003692146,"about_ca_system_score_gemma":0.0002089843,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001638842,"about_ca_topic_score_gemma":0.0005384212,"domain_scores_codex":[0.9998739,0.00002137198,0.00001418151,0.00002660902,0.00002925932,0.00003472643],"domain_scores_gemma":[0.9999392,0.00001194895,0.00001726755,0.000006296311,0.00001326079,0.00001202784],"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":[0.0001500052,0.0001182968,0.0001738984,0.0001042089,0.00001414619,0.0001858942,0.000037272,0.001591763,0.9893883,0.001667503,0.0002466313,0.006321929],"study_design_scores_gemma":[0.0001482779,0.001259728,0.0006194045,0.00001544499,0.00002025363,0.0003586309,0.00002992225,0.003430769,0.9836915,0.0006192967,0.009789026,0.00001779536],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9643078,0.00244451,0.01950842,0.0004942029,0.0001407572,0.0002777668,0.0002400586,0.0003174203,0.01226911],"genre_scores_gemma":[0.9826644,0.001503046,0.01292741,0.0002523446,0.00001810304,0.00009315805,0.0001894659,0.00003175419,0.002320359],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001074723,"threshold_uncertainty_score":0.003595352,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01310537518011159,"score_gpt":0.2637314764766433,"score_spread":0.2506261012965317,"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."}}