{"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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004691794,0.00009918342,0.0001786245,0.00001801384,0.00006672212,0.000002583354,0.0003516014,0.00005010186,0.00008337144],"category_scores_gemma":[0.0002529864,0.0000748881,0.0001710309,0.00008937313,0.00007802722,0.000002782388,0.0002036801,0.000282059,2.309015e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000763264,"about_ca_system_score_gemma":0.000465017,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000002015637,"about_ca_topic_score_gemma":4.749606e-7,"domain_scores_codex":[0.9985986,0.00004765994,0.0005848806,0.0001101467,0.0005495815,0.0001091842],"domain_scores_gemma":[0.9987521,0.00001918082,0.0007832939,0.0002038482,0.0001619118,0.00007967459],"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":[0.0003221244,0.0001660564,0.001118494,0.0000986363,0.00009114272,0.0000105196,0.0002510517,0.0001913735,0.9935465,5.632299e-7,0.002726706,0.001476856],"study_design_scores_gemma":[0.0006363334,0.0001321281,0.0007119146,0.0001396668,0.00005394751,0.000277586,0.001417886,0.00001051067,0.9830635,0.00001437393,0.01347307,0.00006913828],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.998102,0.0009280719,0.00007655868,0.0001878134,0.0003530173,0.00004692974,0.000009108279,0.000001412375,0.0002950943],"genre_scores_gemma":[0.9989053,0.00002047801,0.0004982042,0.00008226014,0.0003432299,0.000004481428,0.000008590877,0.00001069866,0.0001267499],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01074636,"threshold_uncertainty_score":0.3053848,"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."}}