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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 = 'BDBM50040731'   
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))
BDBM50040731
PNG
(CHEMBL3353211)
Show SMILES Cn1cc(cn1)-c1cccc(c1)-c1ncc(cn1)-c1cnn(c1)[C@@H]1CCCN(C1)S(C)(=O)=O |r|
Show InChI InChI=1S/C23H25N7O2S/c1-28-14-20(12-26-28)17-5-3-6-18(9-17)23-24-10-19(11-25-23)21-13-27-30(15-21)22-7-4-8-29(16-22)33(2,31)32/h3,5-6,9-15,22H,4,7-8,16H2,1-2H3/t22-/m1/s1
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Similars

Article
PubMed
n/an/a<100n/an/an/an/an/an/a



Nimbus Discovery

Curated by ChEMBL


Assay Description
Inhibition of IRAK1 (unknown origin) assessed as reduction in biotin tagged phosphorylated peptide substrate1


J Med Chem 58: 96-110 (2015)


Article DOI: 10.1021/jm5016044
BindingDB Entry DOI: 10.7270/Q2P84DHS
More data for this
Ligand-Target Pair