Found 2 hits in this display Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Caspase-3
(Homo sapiens (Human)) | BDBM50002744
(CHEMBL3233642)Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)n2sc3ccccc3c2=O)cc1 Show InChI InChI=1S/C19H20N4O4S2/c1-21-10-12-22(13-11-21)29(26,27)15-8-6-14(7-9-15)20-19(25)23-18(24)16-4-2-3-5-17(16)28-23/h2-9H,10-13H2,1H3,(H,20,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 61 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant caspase-3 using Ac-LDEVD-AMC as substrate after 10 mins by fluorescence assay |
Bioorg Med Chem 22: 2416-26 (2014)
Article DOI: 10.1016/j.bmc.2014.03.002
BindingDB Entry DOI: 10.7270/Q2J38V2W |
More data for this
Ligand-Target Pair | |
Caspase-7
(Homo sapiens (Human)) | BDBM50002744
(CHEMBL3233642)Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)n2sc3ccccc3c2=O)cc1 Show InChI InChI=1S/C19H20N4O4S2/c1-21-10-12-22(13-11-21)29(26,27)15-8-6-14(7-9-15)20-19(25)23-18(24)16-4-2-3-5-17(16)28-23/h2-9H,10-13H2,1H3,(H,20,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 194 | n/a | n/a | n/a | n/a | n/a | n/a |
Tianjin University of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant caspase-7 using Ac-DEVD-AMC as substrate after 10 mins by fluorescence assay |
Bioorg Med Chem 22: 2416-26 (2014)
Article DOI: 10.1016/j.bmc.2014.03.002
BindingDB Entry DOI: 10.7270/Q2J38V2W |
More data for this
Ligand-Target Pair | |