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Target
Neuraminidase
Ligand
BDBM50271265
Substrate
n/a
Meas. Tech.
ChEMBL_1710931 (CHEMBL4120980)
IC50
76±n/a nM
Citation
 McKimm-Breschkin, JL; Barrett, S; Pilling, PA; Hader, S; Watts, AG; Streltsov, VA Structural and Functional Analysis of Anti-Influenza Activity of 4-, 7-, 8- and 9-Deoxygenated 2,3-Difluoro- N-acetylneuraminic Acid Derivatives. J Med Chem 61:1921-1933 (2018) [PubMed]  Article 
Target
Name:
Neuraminidase
Synonyms:
3.2.1.18 | NA | Neuraminidase
Type:
PROTEIN
Mol. Mass.:
51109.42
Organism:
Influenza B virus
Description:
ChEMBL_118085
Residue:
466
Sequence:
MLPSTIQTLTLFLTSGGVLLSLYVSASLSYLLYSDILLKFSPTEITAPTMPLDCANASNVQAVNRSATKGVTLLLPEPEWTYPRLSCPGSTFQKALLISPHRFGETKGNSAPLIIREPFIACGPKECKHFALTHYAAQPGGYYNGTRGDRNKLRHLISVKLGKIPTVENSIFHMAAWSGSACHDGKEWTYIGVDGPDNNALLKIKYGEAYTDTYHSYANNILRTQESACNCIGGNCYLMITDGSASGISECRFLKIREGRIIKEIFPTGRVKHTEECTCGFASNKTIECACRDNSYTAKRPFVKLNVETDTAEIRLMCTETYLDTPRPDDGSITGPCESNGDKGSGGIKGGFVHQRMASKIGRWYSRTMSKTKRMGMGLYVKYDGDPWTDSDALALSGVMVSMEEPGWYSFGFEIKDKKCDVPCIGIEMVHDGGKETWHSAATAIYCLMGSGQLLWDTVTGVDMAL
  
Inhibitor
Name:
BDBM50271265
Synonyms:
CHEMBL4126987
Type:
Small organic molecule
Emp. Form.:
C11H17F2NO7
Mol. Mass.:
313.252
SMILES:
[H][C@]1(O[C@](F)([C@H](F)C[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CO |r|
Structure:
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