Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM50290065 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_200790 |
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IC50 | 12000±n/a nM |
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Citation | Smith, PW; Whittington, AR; Sollis, SL; Howes, PD; Taylor, NR Novel inhibitors of influenza sialidases related to zanamivir. Heterocyclic replacements of the glycerol sidechain Bioorg Med Chem Lett7:2239-2242 (1997) Article |
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More Info.: | Get all data from this article, Assay Method |
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Neuraminidase |
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Name: | Neuraminidase |
Synonyms: | Influenza A Virus Neuraminidase | NA | NRAM_I34A1 | Neuraminidase | Neuraminidase A |
Type: | Enzyme |
Mol. Mass.: | 50124.14 |
Organism: | Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(H1N1)) |
Description: | P03468 |
Residue: | 454 |
Sequence: | MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNST
WVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLT
QGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGI
SGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKI
FKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIG
YICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIW
DPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKT
IWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK
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BDBM50290065 |
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n/a |
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Name | BDBM50290065 |
Synonyms: | (4S,5R,6R)-5-Acetylamino-6-(5-benzyl-1-propyl-1H-[1,2,4]triazol-3-yl)-4-tert-butoxycarbonylamino-5,6-dihydro-4H-pyran-2-carboxylic acid benzhydryl ester | CHEMBL70627 |
Type | Small organic molecule |
Emp. Form. | C38H43N5O6 |
Mol. Mass. | 665.7779 |
SMILES | CCCn1nc(nc1Cc1ccccc1)[C@@H]1OC(=C[C@H](NC(=O)OC(C)(C)C)[C@H]1NC(C)=O)C(=O)OC(c1ccccc1)c1ccccc1 |c:19| |
Structure |
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