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Target
Neuraminidase
Ligand
BDBM5195
Substrate
n/a
Meas. Tech.
ChEMBL_306201 (CHEMBL830159)
IC50
56±n/a nM
Citation
 Wang, GT; Wang, S; Gentles, R; Sowin, T; Maring, CJ; Kempf, DJ; Kati, WM; Stoll, V; Stewart, KD; Laver, G Design, synthesis, and structural analysis of inhibitors of influenza neuraminidase containing a 2,3-disubstituted tetrahydrofuran-5-carboxylic acid core. Bioorg Med Chem Lett 15:125-8 (2004) [PubMed]  Article 
Target
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:
MLPSTVQTLTLLLTSGGVLLSLYVSASLSYLLYSDVLLKFSSTKTTAPTMSLECTNASNAQTVNHSATKEMTFPPPEPEWTYPRLSCQGSTFQKALLISPHRFGEIKGNSAPLIIREPFVACGPKECRHFALTHYAAQPGGYYNGTRKDRNKLRHLVSVKLGKIPTVENSIFHMAAWSGSACHDGREWTYIGVDGPDNDALVKIKYGEAYTDTYHSYAHNILRTQESACNCIGGDCYLMITDGSASGISKCRFLKIREGRIIKEILPTGRVEHTEECTCGFASNKTIECACRDNSYTAKRPFVKLNVETDTAEIRLMCTKTYLDTPRPDDGSIAGPCESNGDKWLGGIKGGFVHQRMASKIGRWYSRTMSKTNRMGMELYVKYDGDPWTDSDALTLSGVMVSIEEPGWYSFGFEIKDKKCDVPCIGIEMVHDGGKDTWHSAATAIYCLMGSGQLLWDTVTGVDMAL
  
Inhibitor
Name:
BDBM5195
Synonyms:
(+/-)-(2R,4R,5S,1 S)-5-(1 -Acetylamino-3 -methylbutyl)-pyrrolidine-2,4-dicarboxylic Acid 4-Methyl Ester Hydrochloride Salt | (2R,4R,5R)-5-[(1S)-1-acetamido-3-methylbutyl]-4-(methoxycarbonyl)pyrrolidine-2-carboxylic acid | CHEMBL369125 | Pyrrolidine deriv. 6
Type:
Small organic molecule
Emp. Form.:
C14H24N2O5
Mol. Mass.:
300.3508
SMILES:
[H][C@]1(N[C@H](C[C@H]1C(=O)OC)C(O)=O)[C@H](CC(C)C)NC(C)=O |r|
Structure:
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