| Reaction Details |
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 | Report a problem with these data |
| Target | Ketohexokinase |
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| Ligand | BDBM601423 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | KHK-C Assay A |
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| IC50 | 30.0±n/a nM |
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| Citation |  Dowling, M; Fernando, D; Futatsugi, K; Huard, K; Magee, TV; Raymer, B; Shavnya, A; Smith, A; Thuma, B; Tsai, A; Tu, M Substituted 3-azabicyclo[3.1.0]hexanes as ketohexokinase inhibitors US Patent US11634410 Publication Date 4/25/2023 |
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| More Info.: | Get all data from this article, Assay Method |
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| Ketohexokinase |
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| Name: | Ketohexokinase |
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| Synonyms: | Hepatic fructokinase | KHK | KHK_HUMAN | Ketohexokinase | Ketohexokinase (KHK) | Ketohexokinase (KHK) Isoform C |
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| Type: | Enzyme Catalytic Domain |
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| Mol. Mass.: | 32521.64 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 298 |
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| Sequence: | MEEKQILCVGLVVLDVISLVDKYPKEDSEIRCLSQRWQRGGNASNSCTVLSLLGAPCAFM
GSMAPGHVADFLVADFRRRGVDVSQVAWQSKGDTPSSCCIINNSNGNRTIVLHDTSLPDV
SATDFEKVDLTQFKWIHIEGRNASEQVKMLQRIDAHNTRQPPEQKIRVSVEVEKPREELF
QLFGYGDVVFVSKDVAKHLGFQSAEEALRGLYGRVRKGAVLVCAWAEEGADALGPDGKLL
HSDAFPPPRVVDTLGAGDTFNASVIFSLSQGRSVQEALRFGCQVAGKKCGLQGFDGIV
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| BDBM601423 |
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| n/a |
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| Name | BDBM601423 |
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| Synonyms: | US11634410, Example 31 | {(1R,5S,6s)-3-[5-cyano-6- (trifluoromethyl)pyridin-2-yl]- 3-azabicyclo[3.1.0]hex-6- yl}acetic acid |
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| Type | Small organic molecule |
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| Emp. Form. | C17H17F3N4O2 |
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| Mol. Mass. | 366.3377 |
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| SMILES | OC(=O)C[C@H]1[C@@H]2CN(C[C@H]12)c1nc(C2CCC2)c(C#N)c(n1)C(F)(F)F |r| |
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| Structure | 
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