{"id":"W2952925461","doi":"10.1002/chin.200931144","title":"ChemInform Abstract: Synthesis of New 1‐(2‐, 3‐, or 4‐Methanesulfonylphenyl)‐2‐[5‐(N‐hydroxypyridin‐2(1H)‐one)]acetylene Regioisomers: A Search for Novel Cyclooxygenase and Lipoxygenase Inhibitors.","year":2009,"lang":"en","type":"article","venue":"ChemInform","topic":"Synthesis and biological activity","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"","keywords":"Chemistry; Acetylene; Structural isomer; Information retrieval; Combinatorial chemistry; Stereochemistry; Organic chemistry; Computer science","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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0005771045,0.0006122795,0.001016687,0.0001324342,0.0001633345,0.00008845822,0.0005484164,0.0006758438,0.001373413],"category_scores_gemma":[0.001277413,0.0004670395,0.0004184676,0.0003322641,0.0002464796,0.0004474344,0.0001601334,0.0003728957,0.00001457009],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001594927,"about_ca_system_score_gemma":0.0002712464,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001472099,"about_ca_topic_score_gemma":0.00001148799,"domain_scores_codex":[0.9968792,2.824667e-7,0.001000046,0.0006958998,0.0005318915,0.000892635],"domain_scores_gemma":[0.9969229,0.001044511,0.0005144618,0.0007354651,0.0001899965,0.0005927312],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0008407628,0.0004228897,0.00001722244,0.000513578,0.00009316376,0.000003879746,0.0002825423,2.382113e-7,0.4552343,0.00005332744,0.003897214,0.5386409],"study_design_scores_gemma":[0.001544393,0.0001728607,0.000538586,0.0003642965,0.0001087156,0.00004130211,0.0006439702,0.00002966897,0.9739643,0.0001139226,0.02182247,0.0006555103],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7205488,0.0006266646,0.000007798901,0.001582431,0.00009603333,0.0007513586,0.0004275254,0.0002911295,0.2756682],"genre_scores_gemma":[0.9867284,0.0004284254,0.0008805688,0.0002232225,0.0007002769,0.00009033547,0.00007719838,0.00004750392,0.01082404],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.5379854,"threshold_uncertainty_score":0.9997782,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04929495029626765,"score_gpt":0.2684380024650851,"score_spread":0.2191430521688175,"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."}}