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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ITK/TSK' and Ligand = 'BDBM26877'   
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
Tyrosine-protein kinase ITK/TSK


(Homo sapiens (Human))
BDBM26877
PNG
(2-aminobenzimidazole with trans-stilbene, 8t | N-[...)
Show SMILES CN(C(=O)c1ccccc1)c1ccc2n(CCC(N)=O)c(NC(=O)c3ccc(C=Cc4cnccn4)s3)nc2c1 |w:28.28|
Show InChI InChI=1S/C29H25N7O3S/c1-35(28(39)19-5-3-2-4-6-19)21-8-11-24-23(17-21)33-29(36(24)16-13-26(30)37)34-27(38)25-12-10-22(40-25)9-7-20-18-31-14-15-32-20/h2-12,14-15,17-18H,13,16H2,1H3,(H2,30,37)(H,33,34,38)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 8n/an/an/an/a7.022



Boehringer Ingelheim Pharmaceuticals Inc.



Assay Description
Kinase is purified as a GST-fusion protein. The kinase activity is measured using DELFIA which utilizes europium chelate-labeled anti-phosphotyrosine...


Bioorg Med Chem Lett 18: 6218-21 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.098
BindingDB Entry DOI: 10.7270/Q23B5XFW
More data for this
Ligand-Target Pair