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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Prostaglandin G/H synthase 1 | ||
| Ligand | BDBM50084349 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_158914 (CHEMBL763302) | ||
| IC50 | 13400±n/a nM | ||
| Citation |  Puig, C; Crespo, MI; Godessart, N; Feixas, J; Ibarzo, J; Jiménez, JM; Soca, L; Cardelús, I; Heredia, A; Miralpeix, M; Puig, J; Beleta, J; Huerta, JM; López, M; Segarra, V; Ryder, H; Palacios, JM Synthesis and biological evaluation of 3,4-diaryloxazolones: A new class of orally active cyclooxygenase-2 inhibitors. J Med Chem43:214-23 (2000) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Prostaglandin G/H synthase 1 | |||
| Name: | Prostaglandin G/H synthase 1 | ||
| Synonyms: | COX-1 | COX1 | Cyclooxygenase | Cyclooxygenase-1 | Cyclooxygenase-1 (COX-1) | PGH1_HUMAN | PTGS1 | Prostaglandin G/H synthase (cyclooxygenase) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 68692.62 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P23219 | ||
| Residue: | 599 | ||
| Sequence: |
| ||
| BDBM50084349 | |||
| n/a | |||
| Name | BDBM50084349 | ||
| Synonyms: | 3-(2-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3H-oxazol-2-one | CHEMBL70158 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C16H12FNO4S | ||
| Mol. Mass. | 333.334 | ||
| SMILES | CS(=O)(=O)c1ccc(cc1)-c1coc(=O)n1-c1ccccc1F |(5.04,-8.06,;6.08,-9.19,;7.18,-10.29,;5.08,-10.45,;7.11,-8.04,;6.63,-6.59,;7.67,-5.45,;9.16,-5.76,;9.64,-7.22,;8.62,-8.36,;10.18,-4.61,;11.71,-4.76,;12.32,-3.35,;11.18,-2.33,;11.34,-.8,;9.85,-3.1,;8.76,-2.01,;9.16,-.51,;8.06,.6,;6.55,.19,;6.15,-1.33,;7.26,-2.42,;6.87,-3.89,)| | ||
| Structure | 
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