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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
5
hits in this display
Target
Caspase-3
(Homo sapiens (Human))
Idun Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50119253
(4-Methyl-2-[3-(naphthalen-1-ylsulfanyl)-propionyla...)
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Affinity Data
IC50: 412nM
Assay Description:
Inhibitory concentration against caspase-3
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Caspase-1
(Homo sapiens (Human))
Idun Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50119253
(4-Methyl-2-[3-(naphthalen-1-ylsulfanyl)-propionyla...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 563nM
Assay Description:
Inhibition of caspase-1
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Caspase-6
(Homo sapiens (Human))
Idun Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50119253
(4-Methyl-2-[3-(naphthalen-1-ylsulfanyl)-propionyla...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 2.72E+3nM
Assay Description:
Inhibitory concentration required against caspase-6
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Caspase-7
(Homo sapiens (Human))
Idun Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50119253
(4-Methyl-2-[3-(naphthalen-1-ylsulfanyl)-propionyla...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 3.60E+3nM
Assay Description:
Inhibitory concentration against caspase-7
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Caspase-8
(Homo sapiens (Human))
Idun Pharmaceuticals
Curated by
ChEMBL
Ligand
BDBM50119253
(4-Methyl-2-[3-(naphthalen-1-ylsulfanyl)-propionyla...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 1.63E+4nM
Assay Description:
Inhibitory concentration against caspase-8
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI