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BDBM50424547 CHEMBL2312144

SMILES: COc1ccc(cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)c(OC)c2)c1)C#N

InChI Key: InChIKey=GOMSKBLQVUFHHS-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50424547   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
TRAF2 and NCK-interacting protein kinase (TNIK)


(Homo sapiens (Human))
BDBM50424547
PNG
(CHEMBL2312144)
Show SMILES COc1ccc(cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)c(OC)c2)c1)C#N
Show InChI InChI=1S/C25H27N5O2/c1-29-10-12-30(13-11-29)22-6-5-20(16-24(22)32-3)28-25-15-19(8-9-27-25)21-14-18(17-26)4-7-23(21)31-2/h4-9,14-16H,10-13H2,1-3H3,(H,27,28)
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Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Astex Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of TNIK (unknown origin) by ADP glo luminescent assay


Bioorg Med Chem Lett 23: 569-73 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.013
BindingDB Entry DOI: 10.7270/Q2G73G1R
More data for this
Ligand-Target Pair