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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bifunctional epoxide hydrolase 2 | ||
| Ligand | BDBM50454635 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1752865 (CHEMBL4187625) | ||
| IC50 | 2.0±n/a nM | ||
| Citation |  Kodani, SD; Bhakta, S; Hwang, SH; Pakhomova, S; Newcomer, ME; Morisseau, C; Hammock, BD Identification and optimization of soluble epoxide hydrolase inhibitors with dual potency towards fatty acid amide hydrolase. Bioorg Med Chem Lett28:762-768 (2018) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bifunctional epoxide hydrolase 2 | |||
| Name: | Bifunctional epoxide hydrolase 2 | ||
| Synonyms: | Cytosolic epoxide hydrolase 2 | EBifunctional epoxide hydrolase 2 | EPHX2 | Epoxide hydratase | HYES_HUMAN | Lipid-phosphate phosphatase | Soluble epoxide hydrolase (sEH) | epoxide hydrolase 2, cytoplasmic | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 62613.07 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P34913 | ||
| Residue: | 555 | ||
| Sequence: |
| ||
| BDBM50454635 | |||
| n/a | |||
| Name | BDBM50454635 | ||
| Synonyms: | CHEMBL4211037 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H24F3N3O6 | ||
| Mol. Mass. | 495.4484 | ||
| SMILES | OC(=O)CNC(=O)c1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:12.11,wD:15.18,(55.81,-41.23,;54.47,-40.46,;54.47,-38.92,;53.14,-41.23,;51.81,-40.46,;50.47,-41.23,;50.47,-42.77,;49.14,-40.46,;47.8,-41.23,;46.47,-40.45,;46.48,-38.91,;45.15,-38.14,;43.81,-38.91,;43.81,-40.45,;42.48,-41.21,;41.15,-40.44,;41.14,-38.91,;42.48,-38.14,;39.82,-41.21,;38.48,-40.44,;38.48,-38.9,;37.15,-41.21,;35.81,-40.45,;34.48,-41.22,;33.14,-40.45,;33.15,-38.9,;31.81,-38.13,;31.81,-36.59,;31.81,-35.19,;33.06,-35.58,;30.56,-35.58,;34.47,-38.13,;35.81,-38.9,;47.81,-38.15,;49.14,-38.91,)| | ||
| Structure | 
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