{"id":"W2003995048","doi":"10.1016/j.bmc.2004.03.063","title":"Design and synthesis of methyl 2-methyl-7,7-dihalo-5-phenyl-2-azabicyclo[4.1.0]hept-3-ene-4-carboxylates with calcium channel antagonist activity","year":2004,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry","topic":"Phenothiazines and Benzothiazines Synthesis and Activities","field":"Biochemistry, Genetics and Molecular Biology","cited_by":14,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Alberta","funders":"","keywords":"Chemistry; Stereochemistry; Moiety; Calcium channel; Antagonist; Substituent; Nitrendipine; Nifedipine; Bioisostere; Methyl group; Dihydropyridine; Calcium; Chemical synthesis; Medicinal chemistry; In vitro; Alkyl; Receptor; Biochemistry; Organic chemistry","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":[0.0002447281,0.0005208006,0.0005415879,0.0002705661,0.0002152429,0.0002406599,0.0006584615,0.0003464258,0.002696991],"category_scores_gemma":[0.0001778559,0.0002905886,0.0002674831,0.0002668341,0.0001862179,0.0002525489,0.0003049268,0.0004541219,0.001141341],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003781716,"about_ca_system_score_gemma":0.0006871138,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000689063,"about_ca_topic_score_gemma":0.001746154,"domain_scores_codex":[0.9998688,0.00002367203,0.0000117756,0.00002196235,0.00002464408,0.00004911002],"domain_scores_gemma":[0.9999226,0.000006735179,0.00001831311,0.000006140673,0.00001742279,0.00002867554],"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":[0.0004403628,0.0001018345,0.0001051528,0.0002424496,0.00002225707,0.0001696067,0.00005206497,0.001124354,0.9839538,0.001156142,0.000305605,0.0123263],"study_design_scores_gemma":[0.0003909468,0.002088585,0.001087539,0.00002064695,0.00006405397,0.0003984815,0.00002844937,0.001615492,0.9779928,0.0002335886,0.01604903,0.00003044195],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9263147,0.007903638,0.0461733,0.0005947355,0.0002571901,0.001043101,0.00165762,0.0004567921,0.01559899],"genre_scores_gemma":[0.9498408,0.007262141,0.02822982,0.0002390907,0.00006867698,0.0005270533,0.001719318,0.00007515607,0.01203783],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002696991,"threshold_uncertainty_score":0.009022355,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01455650296980178,"score_gpt":0.2328963768488073,"score_spread":0.2183398738790055,"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."}}