{"id":"W2048360841","doi":"10.1016/j.bmcl.2010.04.065","title":"Discovery of 4-{1-[({1-[4-(trifluoromethyl)benzyl]-1H-indol-7-yl}carbonyl)amino]cyclopropyl}benzoic acid (MF-766), a highly potent and selective EP4 antagonist for treating inflammatory pain","year":2010,"lang":"en","type":"article","venue":"Bioorganic & Medicinal Chemistry Letters","topic":"Inflammatory mediators and NSAID effects","field":"Medicine","cited_by":39,"is_retracted":false,"has_abstract":false,"ca_institutions":"Merck Canada Inc. (Canada); TransCanada (Canada)","funders":"","keywords":"Chemistry; Benzoic acid; Antagonist; Indole test; Potency; In vivo; Stereochemistry; Derivative (finance); Chemical synthesis; Trifluoromethyl; NK1 receptor antagonist; Pharmacology; Pharmacokinetics; In vitro; Biochemistry; Receptor; Organic chemistry; Medicine; Neuropeptide","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":[0.0001652858,0.0004054545,0.0003737782,0.0002767502,0.0001703837,0.00021323,0.0004031186,0.0003922442,0.001937276],"category_scores_gemma":[0.0001529418,0.0001775651,0.0002238055,0.0001195513,0.0001674775,0.000182484,0.0001877781,0.0005266344,0.0008753551],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003020295,"about_ca_system_score_gemma":0.0003817311,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006495991,"about_ca_topic_score_gemma":0.001535827,"domain_scores_codex":[0.9999212,0.00001453664,0.000004003221,0.00001051028,0.00001913799,0.00003048208],"domain_scores_gemma":[0.9999684,0.000004236424,0.000008385736,0.000002525348,0.000006277967,0.00001015459],"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":[0.0004692466,0.0001501024,0.000182247,0.0002061412,0.00002200446,0.0004785097,0.00003433702,0.0004990582,0.9767298,0.0007061263,0.0006615861,0.01986084],"study_design_scores_gemma":[0.000621242,0.003958052,0.003203289,0.00003122171,0.00009659869,0.001633789,0.00002369439,0.001758758,0.9626287,0.0002168231,0.02580237,0.00002536356],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9381236,0.02032201,0.01639246,0.001761615,0.0003487926,0.0005320184,0.001492529,0.0003706517,0.02065626],"genre_scores_gemma":[0.9717185,0.009355152,0.006915888,0.0004485722,0.0001460033,0.0001615006,0.001089393,0.0000231042,0.01014184],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001937276,"threshold_uncertainty_score":0.006480813,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004648992860490745,"score_gpt":0.2161176122319535,"score_spread":0.2114686193714627,"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."}}