| Reaction Details |
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 | Report a problem with these data |
| Target | Adenosine deaminase |
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| Ligand | BDBM28386 |
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| Substrate/Competitor | BDBM14487 |
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| Meas. Tech. | ADA Enzyme Inhibition Assay |
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| pH | 7.2±n/a |
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| Temperature | 303.15±n/a K |
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| Ki | 28270±2450 nM |
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| Citation |  La Motta, C; Sartini, S; Mugnaini, L; Salerno, S; Simorini, F; Taliani, S; Marini, AM; Da Settimo, F; Lavecchia, A; Novellino, E; Antonioli, L; Fornai, M; Blandizzi, C; Del Tacca, M Exploiting the pyrazolo[3,4-d]pyrimidin-4-one ring system as a useful template to obtain potent adenosine deaminase inhibitors. J Med Chem52:1681-92 (2009) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Adenosine deaminase |
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| Name: | Adenosine deaminase |
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| Synonyms: | ADA | ADA_BOVIN | Adenosine aminohydrolase |
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| Type: | Enzyme |
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| Mol. Mass.: | 40910.44 |
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| Organism: | Bos taurus (bovine) |
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| Description: | n/a |
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| Residue: | 363 |
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| Sequence: | MAQTPAFNKPKVELHVHLDGAIKPETILYYGRKRGIALPADTPEELQNIIGMDKPLSLPE
FLAKFDYYMPAIAGCREAVKRIAYEFVEMKAKDGVVYVEVRYSPHLLANSKVEPIPWNQA
EGDLTPDEVVSLVNQGLQEGERDFGVKVRSILCCMRHQPSWSSEVVELCKKYREQTVVAI
DLAGDETIEGSSLFPGHVKAYAEAVKSGVHRTVHAGEVGSANVVKEAVDTLKTERLGHGY
HTLEDATLYNRLRQENMHFEVCPWSSYLTGAWKPDTEHPVVRFKNDQVNYSLNTDDPLIF
KSTLDTDYQMTKNEMGFTEEEFKRLNINAAKSSFLPEDEKKELLDLLYKAYGMPSPASAE
QCL
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| BDBM28386 |
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| BDBM14487 |
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| Name | BDBM28386 |
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| Synonyms: | 1-(4-methoxyphenyl)-3-[4-({4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyrimidin-2-yl}methyl)phenyl]urea | pyrazolo[3,4-d]pyrimidin-4-one, 14b |
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| Type | Small organic molecule |
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| Emp. Form. | C20H18N6O3 |
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| Mol. Mass. | 390.3953 |
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| SMILES | COc1ccc(NC(=O)Nc2ccc(Cn3cc4c(n3)nc[nH]c4=O)cc2)cc1 |
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| Structure | 
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