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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Amine oxidase [flavin-containing] B | ||
| Ligand | BDBM243411 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | MAO-B Inhibitory Assay | ||
| pH | 7.5±n/a | ||
| Temperature | 298.15±n/a K | ||
| IC50 | >100000±n/a nM | ||
| Comments | extracted | ||
| Citation |  Matsumoto, S; Hattori, Y; Toyofuku, M; Morimoto, S; Kojima, T; Kaku, T; Ito, M Cyclopropanamine compound and use thereof US Patent US9714241 Publication Date 7/25/2017 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Amine oxidase [flavin-containing] B | |||
| Name: | Amine oxidase [flavin-containing] B | ||
| Synonyms: | AOFB_HUMAN | MAO-B | MAOB | Monoamine oxidase type B | Monoamine oxidase type B (MAO B) | Monoamine oxidase type B (MAO B) | Monoamine oxidase type B (MAOB) | ||
| Type: | Protein | ||
| Mol. Mass.: | 58768.76 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P27338 | ||
| Residue: | 520 | ||
| Sequence: |
| ||
| BDBM243411 | |||
| n/a | |||
| Name | BDBM243411 | ||
| Synonyms: | 5-((1R,2R)-2-(cis- (4-aminocyclohexyl)- amino)cyclopropyl)- N-(4,4- difluorocyclohexyl)- thiophene-3- carboxamide or5-((1R,2R)-2-(trans-(4-aminocyclohexyl)-amino)cyclopropyl)-N-(4,4-difluorocyclohexyl)-thiophene-3-carboxamide | US10053456, 45 | US10053456, 46 | US10414761, Example 46 | US10968213, Example 46 | US9718814, 46 | US9920047, 46 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C20H29F2N3OS | ||
| Mol. Mass. | 397.526 | ||
| SMILES | NC1CCC(CC1)N[C@@H]1C[C@H]1c1cc(cs1)C(=O)NC1CCC(F)(F)CC1 |r,wU:10.12,wD:8.8,(10.25,-.24,;8.76,-.64,;8.36,-2.13,;6.87,-2.53,;5.78,-1.44,;6.18,.05,;7.67,.45,;4.3,-1.84,;3.21,-.75,;2.12,-1.84,;1.72,-.35,;.39,.42,;-1.08,-.05,;-1.98,1.19,;-1.08,2.44,;.39,1.96,;-3.52,1.19,;-4.29,2.53,;-4.29,-.14,;-5.83,-.14,;-6.6,1.19,;-8.14,1.19,;-8.91,-.14,;-10.25,.63,;-10.25,-.91,;-8.14,-1.48,;-6.6,-1.48,)| | ||
| Structure | 
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