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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM311530'   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM311530
PNG
(5-{[cis-2- aminocyclohexyl]amino}- N-[1-methyl-3- ...)
Show SMILES CNC(=O)c1nn(C)cc1NC(=O)c1cnn2ccc(N[C@H]3CCCC[C@H]3N)nc12 |r|
Show InChI InChI=1S/C19H25N9O2/c1-21-19(30)16-14(10-27(2)26-16)24-18(29)11-9-22-28-8-7-15(25-17(11)28)23-13-6-4-3-5-12(13)20/h7-10,12-13H,3-6,20H2,1-2H3,(H,21,30)(H,23,25)(H,24,29)/t12-,13+/m1/s1
PDB
MMDB

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US Patent
n/an/a 18n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The kinase activity of IRAK4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phosp...


US Patent US10155765 (2018)


BindingDB Entry DOI: 10.7270/Q21V5H2J
More data for this
Ligand-Target Pair