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Target
Ketohexokinase
Ligand
BDBM50349756
Substrate
n/a
Meas. Tech.
Enzyme Assay
Temperature
298.15±n/a K
IC50
2060±n/a nM
Comments
extracted
Citation
 Zhang, X; Abad, MC; Gibbs, AC; Kuo, G; Kuo, LC; Song, F; Sui, Z Indazole compounds useful as ketohexokinase inhibitors US Patent  US8822447 Publication Date 9/2/2014 
Target
Name:
Ketohexokinase
Synonyms:
Hepatic fructokinase | KHK | KHK_HUMAN | Ketohexokinase | Ketohexokinase (KHK) | Ketohexokinase (KHK) Isoform C
Type:
Enzyme Catalytic Domain
Mol. Mass.:
32521.64
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
298
Sequence:
MEEKQILCVGLVVLDVISLVDKYPKEDSEIRCLSQRWQRGGNASNSCTVLSLLGAPCAFMGSMAPGHVADFLVADFRRRGVDVSQVAWQSKGDTPSSCCIINNSNGNRTIVLHDTSLPDVSATDFEKVDLTQFKWIHIEGRNASEQVKMLQRIDAHNTRQPPEQKIRVSVEVEKPREELFQLFGYGDVVFVSKDVAKHLGFQSAEEALRGLYGRVRKGAVLVCAWAEEGADALGPDGKLLHSDAFPPPRVVDTLGAGDTFNASVIFSLSQGRSVQEALRFGCQVAGKKCGLQGFDGIV
  
Inhibitor
Name:
BDBM50349756
Synonyms:
CHEMBL1809183 | US8822447, 45 | US9771375, Example 45
Type:
Small organic molecule
Emp. Form.:
C23H29N5
Mol. Mass.:
375.5099
SMILES:
CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(CC1)C1CCNC1
Structure:
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