{"id":"W4313288624","doi":"10.1021/acs.jmedchem.2c01803","title":"Development of a Potent Cyclic Peptide Inhibitor of the nNOS/PSD-95 Interaction","year":2022,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Signaling Pathways in Disease","field":"Biochemistry, Genetics and Molecular Biology","cited_by":15,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Janssen Biotech; H2020 Marie Skłodowska-Curie Actions; Genentech; Deutsche Forschungsgemeinschaft; Ontario Genomics Institute; Takeda Pharmaceutical Company; European Federation of Pharmaceutical Industries and Associations; Merck KGaA; Ontario Genomics; Genome Canada; Bayer; Bristol-Myers Squibb; Pfizer; McGill University; Boehringer Ingelheim","keywords":"Chemistry; PDZ domain; Peptide; Postsynaptic density; NMDA receptor; Cyclic peptide; Peptide Conformation; Amino acid; Biophysics; Biochemistry; Receptor","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000093246,0.0003084519,0.0002473906,0.0001334821,0.00008562292,0.0001221183,0.0002759944,0.0001803713,0.0008030977],"category_scores_gemma":[0.0000941144,0.0001003421,0.000137358,0.0000979011,0.0001054043,0.0001178879,0.000151898,0.00033709,0.0001791716],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001844255,"about_ca_system_score_gemma":0.0001794992,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002557824,"about_ca_topic_score_gemma":0.0005030521,"domain_scores_codex":[0.9999473,0.000006078602,0.000005056264,0.00001286234,0.00001532796,0.00001333518],"domain_scores_gemma":[0.9999678,0.000004250293,0.000008851473,0.000002245785,0.000005289263,0.0000115773],"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":[0.0001241401,0.00007563591,0.00007792515,0.00007342582,0.00001099837,0.000074627,0.00000988361,0.0006821978,0.9916077,0.0002344561,0.0001108475,0.006918223],"study_design_scores_gemma":[0.0001386065,0.002041684,0.0009333122,0.00001064123,0.00003444925,0.0003918017,0.00001011399,0.003548157,0.9858801,0.00009034604,0.006908148,0.00001270152],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9733883,0.005378775,0.01492322,0.0001231611,0.00008527662,0.0002996734,0.0003408785,0.0001418475,0.005318905],"genre_scores_gemma":[0.9840958,0.002486526,0.01076916,0.0001220484,0.00002215621,0.0001344652,0.0004802028,0.00001457645,0.001875051],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0008030977,"threshold_uncertainty_score":0.00268656,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01214040825009691,"score_gpt":0.2519791585186862,"score_spread":0.2398387502685893,"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."}}