{"id":"W2008250413","doi":"10.1021/ml500427r","title":"Interconversion of Functional Activity by Minor Structural Alterations in Nonpeptide AT<sub>2</sub> Receptor Ligands","year":2014,"lang":"en","type":"article","venue":"ACS Medicinal Chemistry Letters","topic":"Receptor Mechanisms and Signaling","field":"Biochemistry, Genetics and Molecular Biology","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Sherbrooke","funders":"Canadian Institutes of Health Research; Kjell och Märta Beijers Stiftelse; Knut och Alice Wallenbergs Stiftelse; Vetenskapsrådet; Stiftelsen för Strategisk Forskning","keywords":"Imidazole; Agonist; Substituent; Chemistry; Methylene; Stereochemistry; Biphenyl; Antagonist; Receptor; Derivative (finance); G protein-coupled receptor; Partial agonist; Combinatorial chemistry; Pharmacology; Biochemistry; Medicinal chemistry; Medicine; Organic chemistry","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":[0.0001217617,0.0002403883,0.0001960574,0.00007409821,0.00008835413,0.0002541532,0.0002387793,0.0001705368,0.001907734],"category_scores_gemma":[0.0001378187,0.00009829623,0.0001232102,0.00007942117,0.0002000527,0.0001800536,0.0001303383,0.0004366123,0.0004141394],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001795239,"about_ca_system_score_gemma":0.0001194996,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002411373,"about_ca_topic_score_gemma":0.0003653883,"domain_scores_codex":[0.9999042,0.0000189979,0.000007204947,0.00001400617,0.00002172291,0.00003394188],"domain_scores_gemma":[0.9999493,0.00001054359,0.00001548085,0.000007488584,0.000004965064,0.00001209421],"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":[0.0002107411,0.00002551019,0.00007375006,0.000011454,0.000002985607,0.00004099961,0.00001302523,0.0001087815,0.998122,0.0001555285,0.00002173873,0.001213485],"study_design_scores_gemma":[0.00004670891,0.0008663008,0.002260453,0.000002460613,0.000008776604,0.000217885,0.00001991078,0.0004846606,0.9943078,0.00006215653,0.001715604,0.000007250846],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9974529,0.0003425543,0.0006708991,0.00004996916,0.00001167038,0.0000125796,0.00008334315,0.00003084962,0.00134535],"genre_scores_gemma":[0.9979891,0.0002797173,0.000536858,0.00004841244,0.000007747772,0.00001628501,0.0001300114,0.00001619555,0.0009758439],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001907734,"threshold_uncertainty_score":0.006381989,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004885806709513032,"score_gpt":0.1982484594449402,"score_spread":0.1933626527354272,"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."}}