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Target
Neuraminidase
Ligand
BDBM50021398
Substrate
n/a
Meas. Tech.
ChEMBL_1295475 (CHEMBL3131473)
IC50
5040±n/a nM
Citation
 Grienke, U; Braun, H; Seidel, N; Kirchmair, J; Richter, M; Krumbholz, A; von Grafenstein, S; Liedl, KR; Schmidtke, M; Rollinger, JM Computer-guided approach to access the anti-influenza activity of licorice constituents. J Nat Prod 77:563-70 (2014) [PubMed]  Article
Target
Name:
Neuraminidase
Synonyms:
NA | NRAM_I33A0
Type:
PROTEIN
Mol. Mass.:
49687.56
Organism:
Influenza A virus
Description:
ChEMBL_1347422
Residue:
453
Sequence:
MNPNQKIITIGSICMVVGIISLILQIGNIISIWISHSIQTGNQNHTGICNQGIITYNVVAGQDSTSVILTGNSSLCPIRGWAIHSKDNGIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECTCVNGSCFTIMTDGPSNGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPKDGPGSCGPVSADGANGVKGFSYRYGNGVWIGRTKSDSSRHGFEMIWDPNGWTETDSRFSVRQDVVAMTDRSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPEEETIWTSGSIISFCGVNSDTVDWSWPDGAELPFTIDK
  
Inhibitor
Name:
BDBM50021398
Synonyms:
CHEBI:18088 | FORMONONETIN | NSC-93360
Type:
Small organic molecule
Emp. Form.:
C16H12O4
Mol. Mass.:
268.2641
SMILES:
COc1ccc(cc1)-c1coc2cc(O)ccc2c1=O
Structure:
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