{"id":"W1976205663","doi":"10.1016/j.bmc.2007.10.078","title":"N-Phenyl-N′-(2-chloroethyl)ureas (CEUs) as potential antineoplastic agents. Part 3: Role of carbonyl groups in the covalent binding to the colchicine-binding site","year":2007,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry","topic":"Synthesis and biological activity","field":"Chemistry","cited_by":16,"is_retracted":false,"has_abstract":false,"ca_institutions":"Hôpital Saint-François d'Assise; Université Laval","funders":"","keywords":"Chemistry; Colchicine; Stereochemistry; Covalent bond; Covalent binding; Combinatorial chemistry; Organic chemistry; Internal medicine","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":[0.0001285854,0.0002562665,0.0001540799,0.0001477919,0.0001085798,0.0001045525,0.0002322156,0.0002611403,0.001517855],"category_scores_gemma":[0.0001003253,0.00009101149,0.0000845104,0.0001191839,0.0001841552,0.0001880255,0.000123362,0.0002016584,0.0003486717],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002074641,"about_ca_system_score_gemma":0.000160383,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006205276,"about_ca_topic_score_gemma":0.00158806,"domain_scores_codex":[0.9999591,0.0000140339,0.000001909736,0.000004425936,0.00001009937,0.00001043405],"domain_scores_gemma":[0.9999723,0.000009285326,0.000005633511,0.000001856061,0.000004587986,0.000006382447],"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":[0.0004335175,0.00009785767,0.0003461259,0.0003504678,0.0000098229,0.000224141,0.00002121999,0.0004643068,0.9455539,0.001313664,0.001017378,0.05016763],"study_design_scores_gemma":[0.0001348416,0.001884292,0.004209832,0.00004233242,0.00002720657,0.001080998,0.00002478886,0.001143387,0.9536869,0.0001935258,0.03755919,0.00001279306],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8061735,0.1619039,0.006885036,0.000663625,0.0003096507,0.0000972579,0.0001976039,0.0002015275,0.02356781],"genre_scores_gemma":[0.9219281,0.06184356,0.0038023,0.0002562081,0.0001151871,0.00006928331,0.0002320527,0.0000153595,0.01173792],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001517855,"threshold_uncertainty_score":0.005077779,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01438731949206627,"score_gpt":0.2439826658290379,"score_spread":0.2295953463369717,"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."}}