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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL1' and Ligand = 'BDBM50324797'   
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 ABL1


(Homo sapiens (Human))
BDBM50324797
PNG
(3-(1-(4-chlorobenzyl)-1H-indol-3-yl)-N-(pyridin-4-...)
Show SMILES Clc1ccc(Cn2cc(CCC(=O)Nc3ccncc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H20ClN3O/c24-19-8-5-17(6-9-19)15-27-16-18(21-3-1-2-4-22(21)27)7-10-23(28)26-20-11-13-25-14-12-20/h1-6,8-9,11-14,16H,7,10,15H2,(H,25,26,28)
PDB
MMDB

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Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université de Nantes

Curated by ChEMBL


Assay Description
Inhibition of recombinant c-Abl after 1 hr


Bioorg Med Chem Lett 20: 5203-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.001
BindingDB Entry DOI: 10.7270/Q21C1X3M
More data for this
Ligand-Target Pair