Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM50028503 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1292461 (CHEMBL3124126) |
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IC50 | 0.150000±n/a nM |
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Citation | Schade, D; Kotthaus, J; Riebling, L; Kotthaus, J; Müller-Fielitz, H; Raasch, W; Koch, O; Seidel, N; Schmidtke, M; Clement, B Development of novel potent orally bioavailable oseltamivir derivatives active against resistant influenza A. J Med Chem57:759-69 (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_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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BDBM50028503 |
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n/a |
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Name | BDBM50028503 |
Synonyms: | CHEMBL81717 | Guanidino-Oseltamivir Carboxylicacid |
Type | Small organic molecule |
Emp. Form. | C15H26N4O4 |
Mol. Mass. | 326.3913 |
SMILES | CCC(CC)O[C@@H]1C=C(C[C@H](NC(N)=N)[C@H]1NC(C)=O)C(O)=O |r,c:7| |
Structure |
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