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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 = 'BDBM50174974'   
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))
BDBM50174974
PNG
(CHEMBL3809900)
Show SMILES Cc1nn(-c2ccccc2)c2nc(CNc3ccc(C)cc3)[nH]c(=O)c12
Show InChI InChI=1S/C20H19N5O/c1-13-8-10-15(11-9-13)21-12-17-22-19-18(20(26)23-17)14(2)24-25(19)16-6-4-3-5-7-16/h3-11,21H,12H2,1-2H3,(H,22,23,26)
PDB
MMDB

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Similars

Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Beni-Suef University

Curated by ChEMBL


Assay Description
Inhibition of Abl (unknown origin)


Bioorg Med Chem Lett 26: 3093-7 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.004
BindingDB Entry DOI: 10.7270/Q2930W40
More data for this
Ligand-Target Pair