| Reaction Details |
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 | Report a problem with these data |
| Target | Neuraminidase |
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| Ligand | BDBM4945 |
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| Substrate/Competitor | BDBM4702 |
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| Meas. Tech. | Neuraminidase Inhibition Assay |
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| IC50 | 2±n/a nM |
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| Citation |  Smith, PW; Sollis, SL; Howes, PD; Cherry, PC; Starkey, ID; Cobley, KN; Weston, H; Scicinski, J; Merritt, A; Whittington, A; Wyatt, P; Taylor, N; Green, D; Bethell, R; Madar, S; Fenton, RJ; Morley, PJ; Pateman, T; Beresford, A Dihydropyrancarboxamides related to zanamivir: a new series of inhibitors of influenza virus sialidases. 1. Discovery, synthesis, biological activity, and structure-activity relationships of 4-guanidino- and 4-amino-4H-pyran-6-carboxamides. J Med Chem41:787-97 (1998) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Neuraminidase |
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| Name: | Neuraminidase |
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| Synonyms: | Influenza A Virus Neuraminidase | NA | NRAM_I57A5 | Neuraminidase A |
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| Type: | Enzyme |
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| Mol. Mass.: | 52000.86 |
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| Organism: | Influenza A virus (A/Singapore/1/57(H2N2)) |
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| Description: | Q6XUE4 |
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| Residue: | 469 |
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| Sequence: | MNPNQKIITIGSVSLTIATVCFLMQIAILATTVTLHFKQHECDSPASNQVMPCEPIIIER
NITEIVYLNNTTIEKEICPEVVEYRNWSKPQCQITGFAPFSKDNSIRLSAGGDIWVTREP
YVSCDPGKCYQFALGQGTTLDNKHSNGTIHDRIPHRTLLMNELGVPFHLGTKQVCVAWSS
SSCHDGKAWLHVCVTGDDRNATASFIYDGRLVDSIGSWSQNILRTQESECVCINGTCTVV
MTDGSASGRADTRILFIKEGKIVHISPLSGSAQHIEECSCYPRYPDVRCICRDNWKGSNR
PVIDINMEDYSIDSSYVCSGLVGDTPRNDDSSSNSNCRDPNNERGNPGVKGWAFDNGDDV
WMGRTINKDSRSGYETFKVIGGWSTPNSKSQVNRQVIVDNNNWSGYSGIFSVEGKSCINR
CFYVELIRGRPQETRVWWTSNSIVVFCGTSGTYGTGSWPDGANINFMPI
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| BDBM4945 |
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| BDBM4702 |
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| Name | BDBM4945 |
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| Synonyms: | (2R,3R,4S)-4-amino-3-acetamido-2-[(2-phenylethyl)(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid | CHEMBL73669 | carboxamide deriv. 4p |
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| Type | Small organic molecule |
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| Emp. Form. | C20H27N3O5 |
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| Mol. Mass. | 389.4455 |
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| SMILES | [H][C@]1(OC(=C[C@H](N)[C@H]1NC(C)=O)C(O)=O)C(=O)N(CCC)CCc1ccccc1 |r,c:3| |
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| Structure | 
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