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TargetHexokinase-4
LigandBDBM50447273
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1291251 (CHEMBL3117036)
IC50 6.0±n/a nM
Citation St Jean, DJAshton, KSBartberger, MDChen, JChmait, SCupples, RGalbreath, EHelmering, JHong, FTJordan, SRLiu, LKunz, RKMichelsen, KNishimura, NPennington, LDPoon, SFReid, DSivits, GStec, MMTadesse, STamayo, NVan, GYang, KCZhang, JNorman, MHFotsch, CLloyd, DJHale, 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
More Info.:Get all data from this article,  Assay Method
 
Hexokinase-4
Name:Hexokinase-4
Synonyms:GCK | Glucokinase (GCK) | Glucokinase (GK) | Glucokinase/Glucokinase regulatory protein | HK IV | HK4 | HXK4_HUMAN | Hexokinase-4 | Hexokinase-D
Type:Enzyme
Mol. Mass.:52175.81
Organism:Homo sapiens (Human)
Description:P35557
Residue:465
Sequence:
MLDDRARMEAAKKEKVEQILAEFQLQEEDLKKVMRRMQKEMDRGLRLETHEEASVKMLPT
YVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEEGQWSVKTKHQMYSIPEDAMTGTAE
MLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDIDKGILLNWTKGFKASGAEGNN
VVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDHQCEVGMIVGTGCNACYMEEMQN
VELVEGDEGRMCVNTEWGAFGDSGELDEFLLEYDRLVDESSANPGQQLYEKLIGGKYMGE
LVRLVLLRLVDENLLFHGEASEQLRTRGAFETRFVSQVESDTGDRKQIYNILSTLGLRPS
TTDCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFK
ERFHASVRRLTPSCEITFIESEEGSGRGAALVSAVACKKACMLGQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50447273
n/a
NameBDBM50447273
Synonyms:CHEMBL3114186
TypeSmall organic molecule
Emp. Form.C21H23F3N4O3S
Mol. Mass.468.493
SMILESCC#C[C@H]1CN(CCN1c1ccc(cc1)[C@](C)(O)C(F)(F)F)S(=O)(=O)c1ccc(N)nc1 |r|
Structure
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