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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 = 'BDBM50288610'   
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))
BDBM50288610
PNG
(Alpha-ketocarbonyl derivative | CHEMBL98937)
Show SMILES CC(C)CC(NC(=O)C(CCCN=C(N)N[N+]([O-])=O)NC(=O)C(CCCCCCCCC#N)C1CCCC1)C(=O)CCl |w:12.11|
Show InChI InChI=1S/C29H50ClN7O5/c1-21(2)19-25(26(38)20-30)35-28(40)24(16-12-18-33-29(32)36-37(41)42)34-27(39)23(22-13-9-10-14-22)15-8-6-4-3-5-7-11-17-31/h21-25H,3-16,18-20H2,1-2H3,(H,34,39)(H,35,40)(H3,32,33,36)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for thromboxane TXA2 synthase inhibitory activity using human platelet


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))
BDBM50288610
PNG
(Alpha-ketocarbonyl derivative | CHEMBL98937)
Show SMILES CC(C)CC(NC(=O)C(CCCN=C(N)N[N+]([O-])=O)NC(=O)C(CCCCCCCCC#N)C1CCCC1)C(=O)CCl |w:12.11|
Show InChI InChI=1S/C29H50ClN7O5/c1-21(2)19-25(26(38)20-30)35-28(40)24(16-12-18-33-29(32)36-37(41)42)34-27(39)23(22-13-9-10-14-22)15-8-6-4-3-5-7-11-17-31/h21-25H,3-16,18-20H2,1-2H3,(H,34,39)(H,35,40)(H3,32,33,36)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>1.00E+3n/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