{"id":"W3021670302","doi":"10.1021/acs.joc.0c00339","title":"Discovery of an Isothiazolinone-Containing Antitubercular Natural Product Levesquamide","year":2020,"lang":"en","type":"article","venue":"The Journal of Organic Chemistry","topic":"Microbial Natural Products and Biosynthesis","field":"Medicine","cited_by":20,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of New Brunswick; Nautilus Biosciences (Canada); Agriculture and Agri-Food Canada; University of Prince Edward Island","funders":"Atlantic Canada Opportunities Agency; Canada Research Chairs; Natural Sciences and Engineering Research Council of Canada; Fondation Jean-Louis Lévesque; Canada Foundation for Innovation; Innovation PEI","keywords":"Moiety; Isoniazid; Natural product; Mycobacterium tuberculosis; Chemistry; Rifampicin; Polyketide; Stereochemistry; Streptomyces; Biochemistry; Microbiology; Tuberculosis; Biology; Bacteria; Antibiotics; Gene; Biosynthesis; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001075882,0.0003187559,0.0002929634,0.0003519543,0.000111584,0.0004190862,0.0001892995,0.0003469731,0.0008618227],"category_scores_gemma":[0.0001483586,0.0001121516,0.000278194,0.0002624244,0.0001244175,0.0003125634,0.0002684265,0.0004354624,0.0004905863],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002335392,"about_ca_system_score_gemma":0.0001763221,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002314396,"about_ca_topic_score_gemma":0.0005362337,"domain_scores_codex":[0.9999385,0.00001074831,0.000005236519,0.00001216571,0.0000215982,0.00001176411],"domain_scores_gemma":[0.9999316,0.000007918467,0.00001726974,0.000005427143,0.00001957663,0.00001824494],"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":[0.00007438345,0.00003217105,0.0003228482,0.0001196888,0.000006792286,0.0003447679,0.00002119645,0.0001499203,0.9917828,0.0001932228,0.00008329914,0.006868934],"study_design_scores_gemma":[0.00007121902,0.001440237,0.005658302,0.00007632128,0.00007316857,0.001784921,0.0001400603,0.001616619,0.9611943,0.0004543476,0.02746759,0.00002285735],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9680163,0.009411855,0.01321019,0.0006143455,0.00006930209,0.0001557269,0.00153059,0.0001706189,0.006821014],"genre_scores_gemma":[0.9761287,0.004239978,0.01443524,0.0002192575,0.0000256874,0.00004289572,0.001903893,0.00003159766,0.002972669],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0008618227,"threshold_uncertainty_score":0.002883077,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01357472222491618,"score_gpt":0.2351238191962208,"score_spread":0.2215490969713046,"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."}}