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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))
Imperial College
Curated by
ChEMBL
Ligand
BDBM50273927
((S)-1-(4-Fluorobenzyl)-5-(2-(4-fluorophenoxymethyl...)
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Affinity Data
EC50: 26.1nM
Assay Description:
Inhibition of human recombinant caspase 3 assessed as accumulation of 7-amino-4-methylcoumarin substrate
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
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Target
Caspase-7
(Homo sapiens (Human))
Imperial College
Curated by
ChEMBL
Ligand
BDBM50273927
((S)-1-(4-Fluorobenzyl)-5-(2-(4-fluorophenoxymethyl...)
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Copy InChI
Affinity Data
EC50: 8nM
Assay Description:
Inhibition of human recombinant caspase 7 assessed as accumulation of 7-amino-4-methylcoumarin substrate
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))
Imperial College
Curated by
ChEMBL
Ligand
BDBM50273927
((S)-1-(4-Fluorobenzyl)-5-(2-(4-fluorophenoxymethyl...)
Copy SMILES
Copy InChI
Affinity Data
EC50: >5.00E+3nM
Assay Description:
Inhibition of human recombinant caspase 8 assessed as accumulation of 7-amino-4-methylcoumarin substrate
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-6
(Homo sapiens (Human))
Imperial College
Curated by
ChEMBL
Ligand
BDBM50273927
((S)-1-(4-Fluorobenzyl)-5-(2-(4-fluorophenoxymethyl...)
Copy SMILES
Copy InChI
Affinity Data
EC50: >5.00E+3nM
Assay Description:
Inhibition of human recombinant caspase 6 assessed as accumulation of 7-amino-4-methylcoumarin substrate
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-1
(Homo sapiens (Human))
Imperial College
Curated by
ChEMBL
Ligand
BDBM50273927
((S)-1-(4-Fluorobenzyl)-5-(2-(4-fluorophenoxymethyl...)
Copy SMILES
Copy InChI
Affinity Data
EC50: >5.00E+3nM
Assay Description:
Inhibition of human recombinant caspase 1 assessed as accumulation of 7-amino-4-methylcoumarin substrate
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