Reaction Details |
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Target | Hexokinase-4 |
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Ligand | BDBM50447276 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1291068 (CHEMBL3119630) |
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EC50 | 239±n/a nM |
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Citation | St Jean, DJ; Ashton, KS; Bartberger, MD; Chen, J; Chmait, S; Cupples, R; Galbreath, E; Helmering, J; Hong, FT; Jordan, SR; Liu, L; Kunz, RK; Michelsen, K; Nishimura, N; Pennington, LD; Poon, SF; Reid, D; Sivits, G; Stec, MM; Tadesse, S; Tamayo, N; Van, G; Yang, KC; Zhang, J; Norman, MH; Fotsch, C; Lloyd, DJ; Hale, C Small molecule disruptors of the glucokinase-glucokinase regulatory protein interaction: 2. Leveraging structure-based drug design to identify analogues with improved pharmacokinetic profiles. J Med Chem57:325-38 (2014) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Hexokinase-4 |
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Name: | Hexokinase-4 |
Synonyms: | Gck | Gk | Glucokinase | HK IV | HK4 | HXK4_MOUSE | Hexokinase-4 | Hexokinase-D |
Type: | Enzyme |
Mol. Mass.: | 52075.40 |
Organism: | Mus musculus (Mouse) |
Description: | P52792 |
Residue: | 465 |
Sequence: | MLDDRARMEATKKEKVEQILAEFQLQEEDLKKVMSRMQKEMDRGLKLETHQEASVKMLPT
YVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEAGQWSVKTKHQMYSIPEDAMTGTAE
MLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDIDKGILLNWTKGFKASGAEGNN
IVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDRQCEVGMIVGTGCNACYMEEMQN
VELVEGDEGRMCVNTEWGAFGNSGELDEFLLEYDRMVDESSVNPGQQLYEKIIGGKYMGE
LVRLVLLKLVEENLLFHGEASEQLRTRGAFETRFVSQVESDSGDRRQILNILSTLGLRPS
VADCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFK
ERFHASVRRLTPNCEITFIESEEGSGRGAALVSAVACKKACMLGQ
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BDBM50447276 |
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n/a |
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Name | BDBM50447276 |
Synonyms: | CHEMBL3113985 |
Type | Small organic molecule |
Emp. Form. | C24H30F3N3O4S2 |
Mol. Mass. | 545.638 |
SMILES | CC(O)(c1ccc(cc1)N1CCN(C[C@@H]1CN1C2CCC1COC2)S(=O)(=O)c1cccs1)C(F)(F)F |r| |
Structure |
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