Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM5250 |
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Substrate/Competitor | BDBM4702 |
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Meas. Tech. | Neuraminidase Inhibition Assay |
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IC50 | 99±n/a nM |
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Citation | Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU Carbocyclic influenza neuraminidase inhibitors possessing a C3-cyclic amine side chain: synthesis and inhibitory activity. Bioorg Med Chem Lett10:1257-60 (2000) [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 |
Synonyms: | Influenza B Virus Neuraminidase | NA | NRAM_INBLE | Neuraminidase | Neuraminidase B |
Type: | Enzyme |
Mol. Mass.: | 51446.67 |
Organism: | Influenza B virus (B/Lee/40) |
Description: | n/a |
Residue: | 466 |
Sequence: | MLPSTVQTLTLLLTSGGVLLSLYVSASLSYLLYSDVLLKFSSTKTTAPTMSLECTNASNA
QTVNHSATKEMTFPPPEPEWTYPRLSCQGSTFQKALLISPHRFGEIKGNSAPLIIREPFV
ACGPKECRHFALTHYAAQPGGYYNGTRKDRNKLRHLVSVKLGKIPTVENSIFHMAAWSGS
ACHDGREWTYIGVDGPDNDALVKIKYGEAYTDTYHSYAHNILRTQESACNCIGGDCYLMI
TDGSASGISKCRFLKIREGRIIKEILPTGRVEHTEECTCGFASNKTIECACRDNSYTAKR
PFVKLNVETDTAEIRLMCTKTYLDTPRPDDGSIAGPCESNGDKWLGGIKGGFVHQRMASK
IGRWYSRTMSKTNRMGMELYVKYDGDPWTDSDALTLSGVMVSIEEPGWYSFGFEIKDKKC
DVPCIGIEMVHDGGKDTWHSAATAIYCLMGSGQLLWDTVTGVDMAL
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BDBM5250 |
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BDBM4702 |
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Name | BDBM5250 |
Synonyms: | (3R,4R,5S)-5-amino-3-(azetidin-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid | C3-Cyclic Amine Carbocyclic Analogue 4a |
Type | Small organic molecule |
Emp. Form. | C12H19N3O3 |
Mol. Mass. | 253.2976 |
SMILES | CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCC1)C(O)=O |r,c:8| |
Structure |
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