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)) | BDBM50435974
(CHEMBL2391865)Show SMILES COC[C@@H]1C[C@@H](F)CN1S(=O)(=O)c1ccc2NC(=O)C(=O)c2c1 |r| Show InChI InChI=1S/C14H15FN2O5S/c1-22-7-9-4-8(15)6-17(9)23(20,21)10-2-3-12-11(5-10)13(18)14(19)16-12/h2-3,5,8-9H,4,6-7H2,1H3,(H,16,18,19)/t8-,9+/m1/s1 | 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 | 2.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Westf£lische Wilhelms-Universit£t M£nster
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant caspase-3 using Ac-DEVD-AMC as substrate assessed as accumulation of AMC preincubated for 10 mins followed by substra... |
Eur J Med Chem 64: 562-78 (2013)
Article DOI: 10.1016/j.ejmech.2013.04.011
BindingDB Entry DOI: 10.7270/Q27W6DKM |
More data for this
Ligand-Target Pair | |
Caspase-7
(Homo sapiens (Human)) | BDBM50435974
(CHEMBL2391865)Show SMILES COC[C@@H]1C[C@@H](F)CN1S(=O)(=O)c1ccc2NC(=O)C(=O)c2c1 |r| Show InChI InChI=1S/C14H15FN2O5S/c1-22-7-9-4-8(15)6-17(9)23(20,21)10-2-3-12-11(5-10)13(18)14(19)16-12/h2-3,5,8-9H,4,6-7H2,1H3,(H,16,18,19)/t8-,9+/m1/s1 | 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 | 8.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Westf£lische Wilhelms-Universit£t M£nster
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant caspase-7 using Ac-DEVD-AMC as substrate assessed as accumulation of AMC preincubated for 10 mins followed by substra... |
Eur J Med Chem 64: 562-78 (2013)
Article DOI: 10.1016/j.ejmech.2013.04.011
BindingDB Entry DOI: 10.7270/Q27W6DKM |
More data for this
Ligand-Target Pair | |