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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Chymotrypsin-like protease CTRL-1' and Ligand = 'BDBM50288609'   
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
Chymotrypsin-like protease CTRL-1


(Homo sapiens (Human))
BDBM50288609
PNG
(Alpha-ketocarbonyl derivative | CHEMBL317337)
Show SMILES CCNC(=O)C(=O)C(CC(C)C)NC(=O)C(CCCN=C(N)N[N+]([O-])=O)NC(=O)C(CCCCCCCCC#N)C1CCCC1 |w:19.18|
Show InChI InChI=1S/C31H54N8O6/c1-4-34-30(43)27(40)26(21-22(2)3)37-29(42)25(18-14-20-35-31(33)38-39(44)45)36-28(41)24(23-15-11-12-16-23)17-10-8-6-5-7-9-13-19-32/h22-26H,4-18,20-21H2,1-3H3,(H,34,43)(H,36,41)(H,37,42)(H3,33,35,38)
KEGG

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
n/an/a 22n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of chymotrypsin-like protease of proteasome from postmortem human liver and brain


Bioorg Med Chem Lett 6: 287-290 (1996)


Article DOI: 10.1016/0960-894X(96)00014-5
BindingDB Entry DOI: 10.7270/Q2JQ1112
More data for this
Ligand-Target Pair
Chymotrypsin-like protease CTRL-1


(Homo sapiens (Human))
BDBM50288609
PNG
(Alpha-ketocarbonyl derivative | CHEMBL317337)
Show SMILES CCNC(=O)C(=O)C(CC(C)C)NC(=O)C(CCCN=C(N)N[N+]([O-])=O)NC(=O)C(CCCCCCCCC#N)C1CCCC1 |w:19.18|
Show InChI InChI=1S/C31H54N8O6/c1-4-34-30(43)27(40)26(21-22(2)3)37-29(42)25(18-14-20-35-31(33)38-39(44)45)36-28(41)24(23-15-11-12-16-23)17-10-8-6-5-7-9-13-19-32/h22-26H,4-18,20-21H2,1-3H3,(H,34,43)(H,36,41)(H,37,42)(H3,33,35,38)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
n/an/a 22n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of chymotrypsin-like protease of proteasome from postmortem human liver and brain


Bioorg Med Chem Lett 6: 287-290 (1996)


Article DOI: 10.1016/0960-894X(96)00014-5
BindingDB Entry DOI: 10.7270/Q2JQ1112
More data for this
Ligand-Target Pair