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 |
|---|
Cathepsin S
(Homo sapiens (Human)) | BDBM50425886
(CHEMBL2312671)Show SMILES NC(=O)N1CCc2c(C1)c(nn2CCCN1CCSCC1)-c1ccc(Cl)c(c1)C#Cc1ccc(cc1)C(=O)NC[C@@H]1CCCN1 |r| Show InChI InChI=1S/C34H40ClN7O2S/c35-30-11-10-27(21-26(30)9-6-24-4-7-25(8-5-24)33(43)38-22-28-3-1-13-37-28)32-29-23-41(34(36)44)16-12-31(29)42(39-32)15-2-14-40-17-19-45-20-18-40/h4-5,7-8,10-11,21,28,37H,1-3,12-20,22-23H2,(H2,36,44)(H,38,43)/t28-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen Research& Development, L.L.C.
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin S |
Bioorg Med Chem Lett 23: 1070-4 (2013)
Article DOI: 10.1016/j.bmcl.2012.12.014
BindingDB Entry DOI: 10.7270/Q2T43VD9 |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50425886
(CHEMBL2312671)Show SMILES NC(=O)N1CCc2c(C1)c(nn2CCCN1CCSCC1)-c1ccc(Cl)c(c1)C#Cc1ccc(cc1)C(=O)NC[C@@H]1CCCN1 |r| Show InChI InChI=1S/C34H40ClN7O2S/c35-30-11-10-27(21-26(30)9-6-24-4-7-25(8-5-24)33(43)38-22-28-3-1-13-37-28)32-29-23-41(34(36)44)16-12-31(29)42(39-32)15-2-14-40-17-19-45-20-18-40/h4-5,7-8,10-11,21,28,37H,1-3,12-20,22-23H2,(H2,36,44)(H,38,43)/t28-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen Research& Development, L.L.C.
Curated by ChEMBL
| Assay Description
Inhibition of cathepsin S in human JY cells assessed as invariant chain-li degradation |
Bioorg Med Chem Lett 23: 1070-4 (2013)
Article DOI: 10.1016/j.bmcl.2012.12.014
BindingDB Entry DOI: 10.7270/Q2T43VD9 |
More data for this
Ligand-Target Pair | |