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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Dihydroorotate dehydrogenase (quinone), mitochondrial | ||
| Ligand | BDBM50549952 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | In Vitro Assay: DHODH Enzymatic Assay | ||
| IC50 | 0.267±n/a nM | ||
| Citation |  Kuduk, S; Zhang, Z; DeRatt, L; Wang, A Dihydroorotate dehydrogenase inhibitors US Patent US11505536 Publication Date 11/22/2022 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Dihydroorotate dehydrogenase (quinone), mitochondrial | |||
| Name: | Dihydroorotate dehydrogenase (quinone), mitochondrial | ||
| Synonyms: | DHODH | DHOdehase | Dihydroorotate dehydrogenase | Dihydroorotate dehydrogenase (DHODH) | Dihydroorotate dehydrogenase, mitochondrial | Dihydroorotate oxidase | Dihydroorotate oxidase (DHODH) | PYRD_HUMAN | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 42881.33 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q02127 | ||
| Residue: | 395 | ||
| Sequence: |
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| BDBM50549952 | |||
| n/a | |||
| Name | BDBM50549952 | ||
| Synonyms: | CHEMBL4752247 | US11505536, Example 51 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H21ClF2N4O4 | ||
| Mol. Mass. | 502.898 | ||
| SMILES | CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(18.24,-18.73,;17.61,-17.33,;16.08,-17.17,;15.31,-15.83,;15.94,-14.43,;17.47,-14.26,;13.81,-16.15,;13.65,-17.69,;12.32,-18.45,;10.99,-17.68,;9.65,-18.45,;8.32,-17.68,;6.98,-18.45,;6.99,-19.99,;5.66,-20.76,;4.32,-20,;4.32,-18.46,;2.99,-20.77,;2.99,-22.31,;4.32,-23.08,;4.33,-24.62,;5.66,-25.39,;5.66,-22.31,;7,-23.08,;8.33,-20.76,;8.33,-22.3,;9.65,-19.99,;10.98,-20.77,;12.32,-20,;13.65,-20.77,;8.32,-16.14,;9.65,-15.37,;6.98,-15.37,;15.05,-18.31,;15.37,-19.82,)| | ||
| Structure | 
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