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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM319558'   
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))
BDBM319558
PNG
(4-(5-Methyl-1,3-oxazol-2-yl)-1-{[(2S)-5-oxopyrroli...)
Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3ncc(C)o3)c2cc1C(N)=O |r|
Show InChI InChI=1S/C22H24N4O5/c1-11(2)30-18-7-15-14(6-16(18)20(23)28)17(22-24-8-12(3)31-22)9-25-21(15)29-10-13-4-5-19(27)26-13/h6-9,11,13H,4-5,10H2,1-3H3,(H2,23,28)(H,26,27)/t13-/m0/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 4.30n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...


US Patent US10174000 (2019)


BindingDB Entry DOI: 10.7270/Q27S7QWQ
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM319558
PNG
(4-(5-Methyl-1,3-oxazol-2-yl)-1-{[(2S)-5-oxopyrroli...)
Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3ncc(C)o3)c2cc1C(N)=O |r|
Show InChI InChI=1S/C22H24N4O5/c1-11(2)30-18-7-15-14(6-16(18)20(23)28)17(22-24-8-12(3)31-22)9-25-21(15)29-10-13-4-5-19(27)26-13/h6-9,11,13H,4-5,10H2,1-3H3,(H2,23,28)(H,26,27)/t13-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 89n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
This is an in vitro assay to measure IRAK4 enzymatic activity utilizing the DELFIA (Dissociation-Enhanced Lanthanide Fluorescent Immunoassay, Perkin-...


US Patent US10174000 (2019)


BindingDB Entry DOI: 10.7270/Q27S7QWQ
More data for this
Ligand-Target Pair