{"id":"W2038296305","doi":"10.1016/j.bmcl.2013.12.036","title":"Systematic evaluation of amide bioisosteres leading to the discovery of novel and potent thiazolylimidazolidinone inhibitors of SCD1 for the treatment of metabolic diseases","year":2013,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Biochemical Acid Research Studies","field":"Biochemistry, Genetics and Molecular Biology","cited_by":20,"is_retracted":false,"has_abstract":false,"ca_institutions":"Xenon Pharmaceuticals (Canada)","funders":"","keywords":"Chemistry; Amide; Moiety; Stereochemistry; Potency; Combinatorial chemistry; In vitro; Chemical synthesis; Drug discovery; Biochemistry","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":[0.0003628596,0.0001707464,0.0004229723,0.00002645926,0.00004642532,0.000007782009,0.0002336155,0.00006043778,0.000004376823],"category_scores_gemma":[0.0006825198,0.00008723645,0.0001397897,0.0001264823,0.0004478565,0.00000622377,0.0001011507,0.00003835782,2.163749e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002378574,"about_ca_system_score_gemma":0.00006487039,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00007964703,"about_ca_topic_score_gemma":0.000002741423,"domain_scores_codex":[0.9986011,0.0000449335,0.0004798413,0.0002255298,0.0004679414,0.0001806227],"domain_scores_gemma":[0.9987688,0.0001967463,0.0003174254,0.0003801957,0.0002786895,0.00005810936],"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":[0.000068323,0.0001603396,0.0004547069,0.002546255,0.0004424373,6.404316e-8,0.0002115785,0.00001381361,0.9955016,0.000003380264,0.0002162996,0.0003812528],"study_design_scores_gemma":[0.0007750657,0.0001996563,0.002450423,0.0006183655,0.0005528203,0.000003390632,0.0009980974,0.00008280502,0.9942198,0.000004014111,0.00001609341,0.00007941459],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9801163,0.01607186,0.0003517785,0.00216601,0.00004070236,0.001157733,0.000088445,0.000001965338,0.000005218436],"genre_scores_gemma":[0.9989064,0.0005779112,0.00006719733,0.00006734824,0.0001503384,0.0001827428,0.00002171633,0.00001193062,0.00001439209],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01879013,"threshold_uncertainty_score":0.3557399,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02523996665984042,"score_gpt":0.2824585877782823,"score_spread":0.2572186211184419,"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."}}