null

SMILES COC[C@@H]1CCCN1S(=O)(=O)c1ccc2N(Cc3ccc(OCCOS(=O)(=O)c4ccc(C)cc4)cc3)C(=O)C(=O)c2c1

InChI Key InChIKey=VXDALODUEXZZKU-QHCPKHFHSA-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 6 hits for monomerid = 50200312   

TargetCaspase-3(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataKi:  0.800nMAssay Description:Binding affinity to human caspase 3More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed
TargetCaspase-6(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of caspase 6More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed
TargetCaspase-8(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of caspase 8More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed
TargetCaspase-1(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of caspase 1More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed
TargetCaspase-7(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataIC50: 13.8nMAssay Description:Inhibition of caspase 7More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed
TargetCaspase-3(Homo sapiens (Human))
University Hospital of the Westfälische Wilhelms-Universität

Curated by ChEMBL
LigandPNGBDBM50200312((S)-1-(4-(2-(4-methylphenylsulfonyloxy)ethoxy)benz...)copy SMILEScopy InChI
Affinity DataIC50: 1.70nMAssay Description:Inhibition of caspase 3More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2513XV1PubMed