BDBM50311586 CHEMBL1088462::erystagallin A

SMILES [#6]-[#8]-c1ccc2c(-[#8]-[#6@H]3-c4cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc4-[#8]-[#6][C@@]23[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]

InChI Key InChIKey=TYAQUJKFTFTVPN-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50311586   

TargetSialidase(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
Chosun University

Curated by ChEMBL
LigandPNGBDBM50311586(erystagallin A | CHEMBL1088462)
Affinity DataIC50: 2.77E+4nMAssay Description:Inhibition of Vibrio cholerae neuraminidase assessed as inhibition of 4-MU-NANA hydrolysis after 30 mins by spectrofluorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2010
Entry Details Article
PubMed
TargetSialidase(Clostridium perfringens)
Chosun University

Curated by ChEMBL
LigandPNGBDBM50311586(erystagallin A | CHEMBL1088462)
Affinity DataIC50: 2.04E+3nMAssay Description:Inhibition of Clostridium perfringens neuraminidase assessed as inhibition of 4-MU-NANA hydrolysis after 10 mins by spectrofluorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2010
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Human)
Chosun University

Curated by ChEMBL
LigandPNGBDBM50311586(erystagallin A | CHEMBL1088462)
Affinity DataIC50: 2.08E+4nMAssay Description:Inhibition of human recombinant PTP1B assessed as p-nitrophenol productionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2012
Entry Details Article
PubMed
TargetSialidase(Clostridium perfringens)
Chosun University

Curated by ChEMBL
LigandPNGBDBM50311586(erystagallin A | CHEMBL1088462)
Affinity DataKi:  1.80E+3nMAssay Description:Noncompetitive inhibition of Clostridium perfringens neuraminidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/19/2010
Entry Details Article
PubMed