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Compile Data Set for Download or QSAR

Found 1 hit of ec50 for monomerid = 50328164   
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
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50328164
PNG
(CHEMBL1258129 | N4-methyl-N6-(2-morpholinoethyl)-N...)
Show SMILES CN(c1ccc(OC(F)(F)F)cc1)c1cc(NCCN2CCOCC2)ncn1
Show InChI InChI=1S/C18H22F3N5O2/c1-25(14-2-4-15(5-3-14)28-18(19,20)21)17-12-16(23-13-24-17)22-6-7-26-8-10-27-11-9-26/h2-5,12-13H,6-11H2,1H3,(H,22,23,24)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of Bcr-Abl in mouse BA/F3 cells


J Med Chem 53: 6934-46 (2010)


Article DOI: 10.1021/jm100555f
BindingDB Entry DOI: 10.7270/Q2DJ5FTW
More data for this
Ligand-Target Pair