Reaction Details Report a problem with these data
Target
Hemagglutinin
Ligand
BDBM50360450
Substrate
n/a
Meas. Tech.
ChEMBL_795513 (CHEMBL1935836)
IC50
3900±n/a nM
Citation
 Suzuki, K; Koyama, T; Yingsakmongkon, S; Suzuki, Y; Hatano, K; Matsuoka, K Synthesis and biological evaluation of sialic acid derivatives containing a long hydrophobic chain at the anomeric position and their C-5 linked polymers as potent influenza virus inhibitors. Bioorg Med Chem 20:446-54 (2011) [PubMed]  Article 
Target
Name:
Hemagglutinin
Synonyms:
HA | HEMA_I68A0 | Hemagglutinin HA1 chain | Hemagglutinin HA2 chain
Type:
PROTEIN
Mol. Mass.:
63416.64
Organism:
Influenza A virus (strain A/Aichi/2/1968 H3N2)
Description:
ChEMBL_795513
Residue:
566
Sequence:
MKTIIALSYIFCLALGQDLPGNDNSTATLCLGHHAVPNGTLVKTITDDQIEVTNATELVQSSSTGKICNNPHRILDGIDCTLIDALLGDPHCDVFQNETWDLFVERSKAFSNCYPYDVPDYASLRSLVASSGTLEFITEGFTWTGVTQNGGSNACKRGPGSGFFSRLNWLTKSGSTYPVLNVTMPNNDNFDKLYIWGIHHPSTNQEQTSLYVQASGRVTVSTRRSQQTIIPNIGSRPWVRGLSSRISIYWTIVKPGDVLVINSNGNLIAPRGYFKMRTGKSSIMRSDAPIDTCISECITPNGSIPNDKPFQNVNKITYGACPKYVKQNTLKLATGMRNVPEKQTRGLFGAIAGFIENGWEGMIDGWYGFRHQNSEGTGQAADLKSTQAAIDQINGKLNRVIEKTNEKFHQIEKEFSEVEGRIQDLEKYVEDTKIDLWSYNAELLVALENQHTIDLTDSEMNKLFEKTRRQLRENAEEMGNGCFKIYHKCDNACIESIRNGTYDHDVYRDEALNNRFQIKGVELKSGYKDWILWISFAISCFLLCVVLLGFIMWACQRGNIRCNICI
  
Inhibitor
Name:
BDBM50360450
Synonyms:
CHEMBL1934618
Type:
Small organic molecule
Emp. Form.:
C24H43NO8S
Mol. Mass.:
505.665
SMILES:
CCCCCCCCCCCCS[C@@]1(C[C@H](O)[C@@H](NC(=O)C=C)[C@@H](O1)[C@H](O)[C@H](O)CO)C(O)=O |r|
Structure:
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