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TargetHexokinase-2
LigandBDBM50169041
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1577560 (CHEMBL3807036)
IC50 470±n/a nM
Citation Lin, HZeng, JXie, RSchulz, MJTedesco, RQu, JErhard, KFMack, JFRaha, KRendina, ARSzewczuk, LMKratz, PMJurewicz, AJCecconie, TMartens, SMcDevitt, PJMartin, JDChen, SBJiang, YNickels, LSchwartz, BJSmallwood, AZhao, BCampobasso, NQian, YBriand, JRominger, CMOleykowski, CHardwicke, MALuengo, JI Discovery of a Novel 2,6-Disubstituted Glucosamine Series of Potent and Selective Hexokinase 2 Inhibitors. ACS Med Chem Lett7:217-22 (2016) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Hexokinase-2
Name:Hexokinase-2
Synonyms:HK II | HK2 | HXK2_HUMAN | Hexokinase type II | Hexokinase-2 | Muscle form hexokinase
Type:PROTEIN
Mol. Mass.:102369.70
Organism:Homo sapiens (Human)
Description:ChEMBL_11422
Residue:917
Sequence:
MIASHLLAYFFTELNHDQVQKVDQYLYHMRLSDETLLEISKRFRKEMEKGLGATTHPTAA
VKMLPTFVRSTPDGTEHGEFLALDLGGTNFRVLWVKVTDNGLQKVEMENQIYAIPEDIMR
GSGTQLFDHIAECLANFMDKLQIKDKKLPLGFTFSFPCHQTKLDESFLVSWTKGFKSSGV
EGRDVVALIRKAIQRRGDFDIDIVAVVNDTVGTMMTCGYDDHNCEIGLIVGTGSNACYME
EMRHIDMVEGDEGRMCINMEWGAFGDDGSLNDIRTEFDQEIDMGSLNPGKQLFEKMISGM
YMGELVRLILVKMAKEELLFGGKLSPELLNTGRFETKDISDIEGEKDGIRKAREVLMRLG
LDPTQEDCVATHRICQIVSTRSASLCAATLAAVLQRIKENKGEERLRSTIGVDGSVYKKH
PHFAKRLHKTVRRLVPGCDVRFLRSEDGSGKGAAMVTAVAYRLADQHRARQKTLEHLQLS
HDQLLEVKRRMKVEMERGLSKETHASAPVKMLPTYVCATPDGTEKGDFLALDLGGTNFRV
LLVRVRNGKWGGVEMHNKIYAIPQEVMHGTGDELFDHIVQCIADFLEYMGMKGVSLPLGF
TFSFPCQQNSLDESILLKWTKGFKASGCEGEDVVTLLKEAIHRREEFDLDVVAVVNDTVG
TMMTCGFEDPHCEVGLIVGTGSNACYMEEMRNVELVEGEEGRMCVNMEWGAFGDNGCLDD
FRTEFDVAVDELSLNPGKQRFEKMISGMYLGEIVRNILIDFTKRGLLFRGRISERLKTRG
IFETKFLSQIESDCLALLQVRAILQHLGLESTCDDSIIVKEVCTVVARRAAQLCGAGMAA
VVDRIRENRGLDALKVTVGVDGTLYKLHPHFAKVMHETVKDLAPKCDVSFLQSEDGSGKG
AALITAVACRIREAGQR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50169041
n/a
NameBDBM50169041
Synonyms:CHEMBL3805653
TypeSmall organic molecule
Emp. Form.C24H24Cl2N2O8S2
Mol. Mass.603.492
SMILESOC1O[C@H](CNS(=O)(=O)c2cccc(Cl)c2Cl)[C@@H](O)[C@H](O)[C@H]1NS(=O)(=O)c1cccc(c1)-c1ccccc1 |r|
Structure
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