Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM50028523 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1437608 (CHEMBL3390210) |
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IC50 | 14±n/a nM |
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Citation | Xie, Y; Xu, D; Huang, B; Ma, X; Qi, W; Shi, F; Liu, X; Zhang, Y; Xu, W Discovery of N-substituted oseltamivir derivatives as potent and selective inhibitors of H5N1 influenza neuraminidase. J Med Chem57:8445-58 (2014) [PubMed] 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: | NA | NRAM_I77AB | Neuraminidase |
Type: | PROTEIN |
Mol. Mass.: | 51863.92 |
Organism: | Influenza A virus (strain A/USSR/90/1977 H1N1) |
Description: | ChEMBL_109720 |
Residue: | 470 |
Sequence: | MNPNQKIITIGSICMAIGIISLILQIGNIISIWVSHSIQTGSQNHTGICNQRIITYENST
WVNQTYVNISNTNVVAGKDTTSMTLAGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREP
FISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPIGEAPSPYNSRFESVAWS
ASACHDGMGWLTIGISGPDDGAVAVLKYNGIITETIKSWRKQILRTQESECVCVNGSCFT
IMTDGPSDGPASYRIFKIEKGKITKSIELDAPNSHYEECSCYPDTGTVMCVCRDNWHGSN
RPWVSFNQNLDYQIGYICSGVFGDNPRPKDGKGSCDPVNVDGADGVKGFSYRYGNGVWIG
RTKSNSSRKGFEMIWDPNGWTDTDSNFLVKQDVVAMTDWSGYSGSFVQHPELTGLDCMRP
CFWVELIRGRPREKTTIWTSGSSISFCGVNSDTVNWSWPDGAELPFTIDK
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BDBM50028523 |
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n/a |
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Name | BDBM50028523 |
Synonyms: | CHEMBL3342485 |
Type | Small organic molecule |
Emp. Form. | C25H32N2O4S |
Mol. Mass. | 456.598 |
SMILES | CCC(CC)O[C@@H]1C=C(C[C@H](NCc2ccc(cc2)-c2cccs2)[C@H]1NC(C)=O)C(O)=O |r,c:7| |
Structure |
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