Reaction Details |
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Target | Adenosine kinase |
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Ligand | BDBM50052046 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_736608 (CHEMBL1694989) |
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IC50 | 85000±n/a nM |
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Citation | Butini, S; Gemma, S; Brindisi, M; Borrelli, G; Lossani, A; Ponte, AM; Torti, A; Maga, G; Marinelli, L; La Pietra, V; Fiorini, I; Lamponi, S; Campiani, G; Zisterer, DM; Nathwani, SM; Sartini, S; La Motta, C; Da Settimo, F; Novellino, E; Focher, F Non-nucleoside inhibitors of human adenosine kinase: synthesis, molecular modeling, and biological studies. J Med Chem54:1401-20 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Adenosine kinase |
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Name: | Adenosine kinase |
Synonyms: | ADK | ADK_HUMAN |
Type: | PROTEIN |
Mol. Mass.: | 40545.97 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_1467841 |
Residue: | 362 |
Sequence: | MAAAEEEPKPKKLKVEAPQALRENILFGMGNPLLDISAVVDKDFLDKYSLKPNDQILAED
KHKELFDELVKKFKVEYHAGGSTQNSIKVAQWMIQQPHKAATFFGCIGIDKFGEILKRKA
AEAHVDAHYYEQNEQPTGTCAACITGDNRSLIANLAAANCYKKEKHLDLEKNWMLVEKAR
VCYIAGFFLTVSPESVLKVAHHASENNRIFTLNLSAPFISQFYKESLMKVMPYVDILFGN
ETEAATFAREQGFETKDIKEIAKKTQALPKMNSKRQRIVIFTQGRDDTIMATESEVTAFA
VLDQDQKEIIDTNGAGDAFVGGFLSQLVSDKPLTECIRAGHYAASIIIRRTGCTFPEKPD
FH
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BDBM50052046 |
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n/a |
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Name | BDBM50052046 |
Synonyms: | 5-Ethyl-5-phenyl-6-oxa-10b-aza-benzo[e]azulen-4-one | CHEMBL329653 |
Type | Small organic molecule |
Emp. Form. | C20H17NO2 |
Mol. Mass. | 303.3545 |
SMILES | CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccccc1 |
Structure |
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