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BDBM317371 US9617282, Example 144

SMILES: CC(C)(C)OC(=O)N1CCN(CCn2cc3NC(=O)c4csc(n4)-c4ccnc(NCCOCCNC(=O)c3n2)c4)CC1

InChI Key: InChIKey=QTPOUGYPZFNLIC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 317371   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM317371
PNG
(US9617282, Example 144)
Show SMILES CC(C)(C)OC(=O)N1CCN(CCn2cc3NC(=O)c4csc(n4)-c4ccnc(NCCOCCNC(=O)c3n2)c4)CC1
Show InChI InChI=1S/C28H37N9O5S/c1-28(2,3)42-27(40)36-11-8-35(9-12-36)10-13-37-17-20-23(34-37)25(39)31-7-15-41-14-6-30-22-16-19(4-5-29-22)26-33-21(18-43-26)24(38)32-20/h4-5,16-18H,6-15H2,1-3H3,(H,29,30)(H,31,39)(H,32,38)
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US Patent
n/an/a<100n/an/an/an/an/an/a



BIOGEN MA INC.

US Patent


Assay Description
The biochemical assay is in a AlphaScreen format. The kinase reaction is based on the IRAK-4 phosphorylation of a biotin labeled peptide. The phospho...


US Patent US9617282 (2017)

More data for this
Ligand-Target Pair