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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Procathepsin L' and Ligand = 'BDBM50574815'   
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
Procathepsin L


(Homo sapiens (Human))
BDBM50574815
PNG
(CHEMBL4857486)
Show SMILES F\C(=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccncc1)S(=O)(=O)Oc1ccccc1 |r|
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
60n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human CatL assessed as fluorescence using Cbz-Phe-Arg-AMC as substrate measured using Dixon equation by fluorometric enzyme assays


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01002
BindingDB Entry DOI: 10.7270/Q2CC14G4
More data for this
Ligand-Target Pair
Procathepsin L


(Homo sapiens (Human))
BDBM50574815
PNG
(CHEMBL4857486)
Show SMILES F\C(=C/[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccncc1)S(=O)(=O)Oc1ccccc1 |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
258n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver CatL assessed as fluorescence using Cbz-Phe-Arg-AMC as substrate measured at second inhibition step by fluorometric enzyme ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01002
BindingDB Entry DOI: 10.7270/Q2CC14G4
More data for this
Ligand-Target Pair