{"id":"W4210697732","doi":"10.1039/d1md00382h","title":"Structure–activity relationships of hydrophobic alkyl acrylamides as tissue transglutaminase inhibitors","year":2022,"lang":"en","type":"article","venue":"RSC Medicinal Chemistry","topic":"Blood properties and coagulation","field":"Medicine","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada; Canadian Institutes of Health Research","keywords":"Tissue transglutaminase; Potency; Alkyl; Structure–activity relationship; Chemistry; Biochemistry; Stereochemistry; Pharmacology; Enzyme; Biology; Organic chemistry; In vitro","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":[0.0002856731,0.0003938229,0.0002212478,0.0003380436,0.00006964526,0.0002504187,0.0002120311,0.0001995279,0.002904805],"category_scores_gemma":[0.0004672566,0.0001302756,0.0002590626,0.0003934493,0.0001353521,0.0002665686,0.000110282,0.000450538,0.0004593311],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002654286,"about_ca_system_score_gemma":0.0002028941,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006742121,"about_ca_topic_score_gemma":0.0009460313,"domain_scores_codex":[0.999864,0.0000390348,0.00001426747,0.00002049392,0.00003532829,0.0000268865],"domain_scores_gemma":[0.9997488,0.00009123021,0.00006979702,0.00001874901,0.00003890796,0.00003259599],"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":[0.001017226,0.000264486,0.000704493,0.0001644027,0.00004590016,0.0001021745,0.00003777023,0.007288222,0.9789075,0.000610386,0.0003125401,0.01054488],"study_design_scores_gemma":[0.0001363354,0.006931682,0.006108804,0.00001812029,0.0001306799,0.0004245989,0.00004138332,0.01352592,0.9675605,0.0003363964,0.004758165,0.00002737925],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9719149,0.01238078,0.005884101,0.0001962335,0.00004900853,0.00008869915,0.001167581,0.0001457034,0.008173088],"genre_scores_gemma":[0.99133,0.003210318,0.002089751,0.00004924259,0.00001489201,0.00003961458,0.001031419,0.00001099455,0.002223665],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002904805,"threshold_uncertainty_score":0.009717524,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01640431018999044,"score_gpt":0.2485134034732506,"score_spread":0.2321090932832602,"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."}}