{"id":"W2082448040","doi":"10.1016/j.bmcl.2006.01.084","title":"Ketopiperazine-based renin inhibitors: Optimization of the “C” ring","year":2006,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Receptor Mechanisms and Signaling","field":"Biochemistry, Genetics and Molecular Biology","cited_by":37,"is_retracted":false,"has_abstract":false,"ca_institutions":"NAEJA-RGM Pharmaceuticals (Canada)","funders":"","keywords":"Chemistry; Steric effects; Renin–angiotensin system; Stereochemistry; Enzyme inhibitor; Ring (chemistry); Enzyme; Renin inhibitor; Inhibitory postsynaptic potential; CYP3A4; Side chain; Reduction (mathematics); Biological activity; Pharmacology; In vitro; Biochemistry; Internal medicine; Polymer; Organic chemistry; Blood pressure","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004667667,0.0006029506,0.0004397287,0.0002091491,0.0002038827,0.0003402655,0.0007275025,0.0002876905,0.00213742],"category_scores_gemma":[0.0002859808,0.000201874,0.0002208467,0.0002338971,0.0003025967,0.0005209101,0.0002763383,0.0008259475,0.0006610841],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004125519,"about_ca_system_score_gemma":0.0004710185,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008193158,"about_ca_topic_score_gemma":0.001688809,"domain_scores_codex":[0.9998339,0.00003863388,0.00001528277,0.00003259099,0.00003672855,0.00004289582],"domain_scores_gemma":[0.9999028,0.00001862953,0.00002864676,0.00001280378,0.00001264405,0.00002451895],"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":[0.006267814,0.0008865893,0.0006488972,0.0009126432,0.0001067456,0.001716389,0.0001624454,0.01994414,0.8589887,0.009930801,0.003996217,0.09643869],"study_design_scores_gemma":[0.002004134,0.006015229,0.001526268,0.00006125242,0.0001730931,0.001550451,0.00005959206,0.01362789,0.9433931,0.001383093,0.03007825,0.0001276464],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9339295,0.009623293,0.03247241,0.0009955682,0.0002466633,0.0004676782,0.0009399289,0.000695309,0.02062971],"genre_scores_gemma":[0.9769835,0.005391477,0.01307313,0.0003117418,0.00006318987,0.00009032,0.0004659535,0.00005192773,0.003568655],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00213742,"threshold_uncertainty_score":0.007150412,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004173212106342079,"score_gpt":0.1868760531013735,"score_spread":0.1827028409950314,"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."}}