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Target
Neuraminidase
Ligand
BDBM50233744
Substrate
n/a
Meas. Tech.
ChEMBL_462436 (CHEMBL927252)
Ki
2.8±n/a nM
Citation
 Krueger, AC; Xu, Y; Kati, WM; Kempf, DJ; Maring, CJ; McDaniel, KF; Molla, A; Montgomery, D; Kohlbrenner, WE Synthesis of potent pyrrolidine influenza neuraminidase inhibitors. Bioorg Med Chem Lett 18:1692-5 (2008) [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:
BDBM50233744
Synonyms:
(2R,4S,5R)-5-((1R,2S)-1-acetamido-2-hydroxybutyl)-4-(prop-1-enyl)pyrrolidine-2-carboxylic acid | CHEMBL253839
Type:
Small organic molecule
Emp. Form.:
C14H24N2O4
Mol. Mass.:
284.3514
SMILES:
CC[C@H](O)[C@H](NC(C)=O)[C@@H]1N[C@H](C[C@H]1\C=C/C)C(O)=O
Structure:
Search PDB for entries with ligand similarity: