| Reaction Details |
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 | Report a problem with these data |
| Target | Hexokinase-2 |
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| Ligand | BDBM50169042 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1577558 (CHEMBL3807034) |
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| IC50 | 7.9±n/a nM |
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| Citation |  Lin, H; Zeng, J; Xie, R; Schulz, MJ; Tedesco, R; Qu, J; Erhard, KF; Mack, JF; Raha, K; Rendina, AR; Szewczuk, LM; Kratz, PM; Jurewicz, AJ; Cecconie, T; Martens, S; McDevitt, PJ; Martin, JD; Chen, SB; Jiang, Y; Nickels, L; Schwartz, BJ; Smallwood, A; Zhao, B; Campobasso, N; Qian, Y; Briand, J; Rominger, CM; Oleykowski, C; Hardwicke, MA; Luengo, 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 |
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| More Info.: | Get all data from this article, Assay Method |
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| Hexokinase-2 |
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| Name: | Hexokinase-2 |
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| Synonyms: | HK II | HK2 | HXK2_HUMAN | Hexokinase type II | Hexokinase-2 | Muscle form hexokinase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 102369.70 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_11422 |
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| Residue: | 917 |
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| Sequence: | MIASHLLAYFFTELNHDQVQKVDQYLYHMRLSDETLLEISKRFRKEMEKGLGATTHPTAA
VKMLPTFVRSTPDGTEHGEFLALDLGGTNFRVLWVKVTDNGLQKVEMENQIYAIPEDIMR
GSGTQLFDHIAECLANFMDKLQIKDKKLPLGFTFSFPCHQTKLDESFLVSWTKGFKSSGV
EGRDVVALIRKAIQRRGDFDIDIVAVVNDTVGTMMTCGYDDHNCEIGLIVGTGSNACYME
EMRHIDMVEGDEGRMCINMEWGAFGDDGSLNDIRTEFDQEIDMGSLNPGKQLFEKMISGM
YMGELVRLILVKMAKEELLFGGKLSPELLNTGRFETKDISDIEGEKDGIRKAREVLMRLG
LDPTQEDCVATHRICQIVSTRSASLCAATLAAVLQRIKENKGEERLRSTIGVDGSVYKKH
PHFAKRLHKTVRRLVPGCDVRFLRSEDGSGKGAAMVTAVAYRLADQHRARQKTLEHLQLS
HDQLLEVKRRMKVEMERGLSKETHASAPVKMLPTYVCATPDGTEKGDFLALDLGGTNFRV
LLVRVRNGKWGGVEMHNKIYAIPQEVMHGTGDELFDHIVQCIADFLEYMGMKGVSLPLGF
TFSFPCQQNSLDESILLKWTKGFKASGCEGEDVVTLLKEAIHRREEFDLDVVAVVNDTVG
TMMTCGFEDPHCEVGLIVGTGSNACYMEEMRNVELVEGEEGRMCVNMEWGAFGDNGCLDD
FRTEFDVAVDELSLNPGKQRFEKMISGMYLGEIVRNILIDFTKRGLLFRGRISERLKTRG
IFETKFLSQIESDCLALLQVRAILQHLGLESTCDDSIIVKEVCTVVARRAAQLCGAGMAA
VVDRIRENRGLDALKVTVGVDGTLYKLHPHFAKVMHETVKDLAPKCDVSFLQSEDGSGKG
AALITAVACRIREAGQR
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| BDBM50169042 |
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| n/a |
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| Name | BDBM50169042 |
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| Synonyms: | CHEMBL3806103 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H23Cl3N2O8S2 |
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| Mol. Mass. | 637.937 |
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| SMILES | OC1O[C@H](CNS(=O)(=O)c2cccc(Cl)c2Cl)[C@@H](O)[C@H](O)[C@H]1NS(=O)(=O)c1cccc(c1)-c1ccc(Cl)cc1 |r| |
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| Structure | 
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