BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Cathepsin B' and Ligand = 'BDBM50460494'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cathepsin B


(Homo sapiens (Human))
BDBM50460494
PNG
(CHEMBL4228345)
Show SMILES Oc1ccc([N+]([O-])=O)c2ccc(nc12)C#N
Show InChI InChI=1S/C10H5N3O3/c11-5-6-1-2-7-8(13(15)16)3-4-9(14)10(7)12-6/h1-4,14H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
6.80E+4n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Mixed inhibition of recombinant human cathepsin B endopeptidase activity assessed as inhibitory constant for enzyme-substrate-inhibitor complex using...


Bioorg Med Chem Lett 28: 1239-1247 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.042
BindingDB Entry DOI: 10.7270/Q218394B
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50460494
PNG
(CHEMBL4228345)
Show SMILES Oc1ccc([N+]([O-])=O)c2ccc(nc12)C#N
Show InChI InChI=1S/C10H5N3O3/c11-5-6-1-2-7-8(13(15)16)3-4-9(14)10(7)12-6/h1-4,14H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.23E+5n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant human cathepsin B endopeptidase activity assessed as inhibitory constant for enzyme-inhibitor complex using Z-A...


Bioorg Med Chem Lett 28: 1239-1247 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.042
BindingDB Entry DOI: 10.7270/Q218394B
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50460494
PNG
(CHEMBL4228345)
Show SMILES Oc1ccc([N+]([O-])=O)c2ccc(nc12)C#N
Show InChI InChI=1S/C10H5N3O3/c11-5-6-1-2-7-8(13(15)16)3-4-9(14)10(7)12-6/h1-4,14H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.42E+5n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Mixed inhibition of recombinant human cathepsin B endopeptidase activity assessed as inhibitory constant for enzyme-inhibitor complex using Z-Arg-Arg...


Bioorg Med Chem Lett 28: 1239-1247 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.042
BindingDB Entry DOI: 10.7270/Q218394B
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50460494
PNG
(CHEMBL4228345)
Show SMILES Oc1ccc([N+]([O-])=O)c2ccc(nc12)C#N
Show InChI InChI=1S/C10H5N3O3/c11-5-6-1-2-7-8(13(15)16)3-4-9(14)10(7)12-6/h1-4,14H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.14E+5n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Non-competitive inhibition of recombinant human cathepsin B exopeptidase activity assessed as inhibitory constant for enzyme-substrate-inhibitor comp...


Bioorg Med Chem Lett 28: 1239-1247 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.042
BindingDB Entry DOI: 10.7270/Q218394B
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50460494
PNG
(CHEMBL4228345)
Show SMILES Oc1ccc([N+]([O-])=O)c2ccc(nc12)C#N
Show InChI InChI=1S/C10H5N3O3/c11-5-6-1-2-7-8(13(15)16)3-4-9(14)10(7)12-6/h1-4,14H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.14E+5n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Non-competitive inhibition of recombinant human cathepsin B exopeptidase activity assessed as inhibitory constant for enzyme-inhibitor complex using ...


Bioorg Med Chem Lett 28: 1239-1247 (2018)


Article DOI: 10.1016/j.bmcl.2018.02.042
BindingDB Entry DOI: 10.7270/Q218394B
More data for this
Ligand-Target Pair