null

SMILES COc1ccc(\C=C\C(=O)\C=C\c2nc(C)c(C)nc2C)c(OC)c1

InChI Key InChIKey=SFBAWNLZAIHSLJ-ZOIFJEAISA-N

  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 = 50533349   

TargetThioredoxin reductase 3(Homo sapiens (Human))
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50533349(CHEMBL4442682)copy SMILEScopy InChI
Affinity DataIC50: 7.63E+3nMAssay Description:Inhibition of thioredoxin reductase (unknown origin) after 2 hrs by DTNB dye based microplate spectrophotometryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2VD72X3PubMed
TargetThioredoxin reductase 3(Homo sapiens (Human))
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50533349(CHEMBL4442682)copy SMILEScopy InChI
Affinity DataIC50: 4.26E+3nMAssay Description:Inhibition of thioredoxin reductase in human A549/CDDP cells by DTNB dye based microplate spectrophotometryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2VD72X3PubMed
TargetThioredoxin reductase 3(Homo sapiens (Human))
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50533349(CHEMBL4442682)copy SMILEScopy InChI
Affinity DataIC50: 4.12E+3nMAssay Description:Inhibition of thioredoxin reductase in human A549 cells by DTNB dye based microplate spectrophotometryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2VD72X3PubMed