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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Pro-cathepsin H' and Ligand = 'BDBM50460480'   
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
Pro-cathepsin H


(Homo sapiens (Human))
BDBM50460480
PNG
(CHEMBL4229176)
Show SMILES Cc1ccc2c(ccc(O)c2n1)[N+]([O-])=O
Show InChI InChI=1S/C10H8N2O3/c1-6-2-3-7-8(12(14)15)4-5-9(13)10(7)11-6/h2-5,13H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
8.90E+4n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Non-competitive inhibition of human liver cathepsin H assessed as inhibitory constant for enzyme-substrate-inhibitor complex using R-AMC as substrate...


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
Pro-cathepsin H


(Homo sapiens (Human))
BDBM50460480
PNG
(CHEMBL4229176)
Show SMILES Cc1ccc2c(ccc(O)c2n1)[N+]([O-])=O
Show InChI InChI=1S/C10H8N2O3/c1-6-2-3-7-8(12(14)15)4-5-9(13)10(7)11-6/h2-5,13H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
8.90E+4n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Non-competitive inhibition of human liver cathepsin H assessed as inhibitory constant for enzyme-inhibitor complex using R-AMC as substrate in presen...


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