{"id":"W4410382461","doi":"10.1021/acs.jmedchem.4c03083","title":"Discovery of Imidazo[1,2-<i>b</i>]pyridazine Derivatives as Potent and Highly Selective Irreversible Bruton’s Tyrosine Kinase (BTK) Inhibitors","year":2025,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Chronic Lymphocytic Leukemia Research","field":"Medicine","cited_by":5,"is_retracted":false,"has_abstract":true,"ca_institutions":"Artificial Intelligence in Medicine (Canada)","funders":"Science and Technology Innovation Talents in Universities of Henan Province; Henan Provincial Science and Technology Research Project; Education Department of Henan Province; National Natural Science Foundation of China; Henan Normal University","keywords":"Bruton's tyrosine kinase; Chemistry; Pyridazine; Tyrosine kinase; Stereochemistry; Biochemistry; Signal transduction","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":[0.0001845008,0.0004579339,0.0004133681,0.0002637322,0.0001104795,0.0002728985,0.000349555,0.0002537329,0.001066339],"category_scores_gemma":[0.000131338,0.00018454,0.0001845245,0.000245941,0.0001624573,0.0002150527,0.0002285156,0.0004125393,0.0003822278],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000331631,"about_ca_system_score_gemma":0.0002488709,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000487522,"about_ca_topic_score_gemma":0.001395539,"domain_scores_codex":[0.999922,0.0000135919,0.000004634049,0.00001498416,0.00001752455,0.00002720158],"domain_scores_gemma":[0.9999645,0.00000390937,0.000009700618,0.000002943198,0.000006224443,0.00001284102],"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":[0.0005562482,0.0004347228,0.0004235026,0.0003730838,0.00004331314,0.0003844843,0.00008697174,0.002897675,0.9533514,0.001963185,0.00169664,0.03778875],"study_design_scores_gemma":[0.001605847,0.008182541,0.004977246,0.00007121183,0.0001054625,0.00120933,0.00003968725,0.008497804,0.9354569,0.0005380113,0.03925345,0.00006249816],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9495551,0.01698049,0.01521972,0.0005415881,0.0001666562,0.0006790902,0.001613862,0.0004372406,0.01480634],"genre_scores_gemma":[0.9794483,0.007030431,0.007975515,0.0002096897,0.00003320654,0.0001667935,0.000931936,0.00002327405,0.004180893],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001066339,"threshold_uncertainty_score":0.003567219,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007690525082136716,"score_gpt":0.2831167849496755,"score_spread":0.2754262598675388,"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."}}