Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM4929 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_532949 (CHEMBL986926) |
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IC50 | 12000518±n/a nM |
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Citation | Lü, WJ; Chen, YL; Ma, WP; Zhang, XY; Luan, F; Liu, MC; Chen, XG; Hu, ZD QSAR study of neuraminidase inhibitors based on heuristic method and radial basis function network. Eur J Med Chem43:569-76 (2008) [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_I33A0 |
Type: | PROTEIN |
Mol. Mass.: | 49687.56 |
Organism: | Influenza A virus |
Description: | ChEMBL_1347422 |
Residue: | 453 |
Sequence: | MNPNQKIITIGSICMVVGIISLILQIGNIISIWISHSIQTGNQNHTGICNQGIITYNVVA
GQDSTSVILTGNSSLCPIRGWAIHSKDNGIRIGSKGDVFVIREPFISCSHLECRTFFLTQ
GALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGIS
GPDNGAVAVLKYNGIITETIKSWRKKILRTQESECTCVNGSCFTIMTDGPSNGLASYKIF
KIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGY
ICSGVFGDNPRPKDGPGSCGPVSADGANGVKGFSYRYGNGVWIGRTKSDSSRHGFEMIWD
PNGWTETDSRFSVRQDVVAMTDRSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPEEETI
WTSGSIISFCGVNSDTVDWSWPDGAELPFTIDK
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BDBM4929 |
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n/a |
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Name | BDBM4929 |
Synonyms: | (2R,3R,4S)-4-amino-2-(dipropylcarbamoyl)-3-acetamido-3,4-dihydro-2H-pyran-6-carboxylic acid | CHEMBL295490 | carboxamide deriv. 4g |
Type | Small organic molecule |
Emp. Form. | C15H25N3O5 |
Mol. Mass. | 327.3761 |
SMILES | [H][C@]1(OC(=C[C@H](N)[C@H]1NC(C)=O)C(O)=O)C(=O)N(CCC)CCC |r,c:3| |
Structure |
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