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PubMed code 26879854

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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


(Bos taurus (bovine))
BDBM50147766
PNG
(CHEMBL3765121)
Show SMILES COc1ccccc1\C=C\C(=O)N[C@@H](COC(=O)c1ccccc1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C26H30N2O5/c1-32-23-15-9-8-10-19(23)16-17-24(29)28-22(25(30)27-21-13-6-3-7-14-21)18-33-26(31)20-11-4-2-5-12-20/h2,4-5,8-12,15-17,21-22H,3,6-7,13-14,18H2,1H3,(H,27,30)(H,28,29)/b17-16+/t22-/m0/s1
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PC cid
PC sid
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Article
PubMed
n/an/a 1.70E+5n/an/an/an/an/an/a



Yamagata University

Curated by ChEMBL


Assay Description
Inhibition of bovine spleen cathepsin B using Z-Arg-Arg-MCA as substrate incubated for 10 mins


Bioorg Med Chem 24: 1241-54 (2016)


Article DOI: 10.1016/j.bmc.2016.01.052
BindingDB Entry DOI: 10.7270/Q23T9K25
More data for this
Ligand-Target Pair
Cathepsin B


(Bos taurus (bovine))
BDBM50147767
PNG
(CHEMBL3765089)
Show SMILES COc1cc(\C=C\C(=O)N[C@H](COC(=O)c2ccccc2)C(=O)NC2CCCCC2)cc(OC)c1OC
Show InChI InChI=1S/C28H34N2O7/c1-34-23-16-19(17-24(35-2)26(23)36-3)14-15-25(31)30-22(27(32)29-21-12-8-5-9-13-21)18-37-28(33)20-10-6-4-7-11-20/h4,6-7,10-11,14-17,21-22H,5,8-9,12-13,18H2,1-3H3,(H,29,32)(H,30,31)/b15-14+/t22-/m1/s1
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+5n/an/an/an/an/an/a



Yamagata University

Curated by ChEMBL


Assay Description
Inhibition of bovine spleen cathepsin B using Z-Arg-Arg-MCA as substrate incubated for 10 mins


Bioorg Med Chem 24: 1241-54 (2016)


Article DOI: 10.1016/j.bmc.2016.01.052
BindingDB Entry DOI: 10.7270/Q23T9K25
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%