Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM50083321 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_144589 (CHEMBL749506) |
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Ki | 1690±n/a nM |
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Citation | Wall, ID; Leach, AR; Salt, DW; Ford, MG; Essex, JW Binding constants of neuraminidase inhibitors: An investigation of the linear interaction energy method. J Med Chem42:5142-52 (2000) [PubMed] |
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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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BDBM50083321 |
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n/a |
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Name | BDBM50083321 |
Synonyms: | 3-Acetylamino-6-dihydroxymethyl-2-ethylcarbamoyl-3,4-dihydro-2H-pyran-4-yl-ammonium |
Type | Small organic molecule |
Emp. Form. | C11H20N3O5 |
Mol. Mass. | 274.2931 |
SMILES | CCNC(=O)[C@@H]1OC(=C[C@H]([NH3+])[C@H]1NC(C)=O)C(O)O |c:7| |
Structure |
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