BDBM50542719 CHEMBL4639026

SMILES CC(=O)c1cc(C)c(O)c(Cc2[nH]c3ccccc3c2Cc2c(O)c(C)cc(C(C)=O)c2O)c1O

InChI Key InChIKey=HDCHEJJWHSXQFS-UHFFFAOYSA-N

Data  3 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50542719   

TargetHemagglutinin(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50542719(CHEMBL4639026)
Affinity DataKd:  6.30E+3nMAssay Description:Binding affinity to Influenza A virus (A/Puerto Rico/8/1934(H1N1)) Hemagglutinin at 1.5625 to 50 uM by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetHemagglutinin(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50542719(CHEMBL4639026)
Affinity DataKd:  6.90E+3nMAssay Description:Binding affinity to Influenza A virus (A/California/04/2009(H1N1)) Hemagglutinin at 1.5625 to 50 uM by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetHemagglutinin(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)
Ocean University of China

Curated by ChEMBL
LigandPNGBDBM50542719(CHEMBL4639026)
Affinity DataKd:  8.40E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed