BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM50040798'   
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))
BDBM50040798
PNG
(CHEMBL3353190 | US10023562, Example 12 | US1054413...)
Show SMILES CC(C)Nc1cc(Nc2ncc(cc2Cl)C#N)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r|
Show InChI InChI=1S/C20H24ClFN6O2/c1-11(2)27-15-6-17(28-18-14(21)5-12(7-23)8-25-18)24-9-13(15)19(29)26-10-16(22)20(3,4)30/h5-6,8-9,11,16,30H,10H2,1-4H3,(H,26,29)(H2,24,25,27,28)/t16-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.90n/an/an/an/an/an/a



Nimbus Discovery

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin) using fluoresceinated peptide and ATP after 60 mins by by Caliper assay


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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM50040798
PNG
(CHEMBL3353190 | US10023562, Example 12 | US1054413...)
Show SMILES CC(C)Nc1cc(Nc2ncc(cc2Cl)C#N)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r|
Show InChI InChI=1S/C20H24ClFN6O2/c1-11(2)27-15-6-17(28-18-14(21)5-12(7-23)8-25-18)24-9-13(15)19(29)26-10-16(22)20(3,4)30/h5-6,8-9,11,16,30H,10H2,1-4H3,(H,26,29)(H2,24,25,27,28)/t16-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.90n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...


US Patent US10544133 (2020)


BindingDB Entry DOI: 10.7270/Q23R0W8G
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM50040798
PNG
(CHEMBL3353190 | US10023562, Example 12 | US1054413...)
Show SMILES CC(C)Nc1cc(Nc2ncc(cc2Cl)C#N)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r|
Show InChI InChI=1S/C20H24ClFN6O2/c1-11(2)27-15-6-17(28-18-14(21)5-12(7-23)8-25-18)24-9-13(15)19(29)26-10-16(22)20(3,4)30/h5-6,8-9,11,16,30H,10H2,1-4H3,(H,26,29)(H2,24,25,27,28)/t16-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.90n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...


US Patent US9657009 (2017)


BindingDB Entry DOI: 10.7270/Q2D79DGD
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM50040798
PNG
(CHEMBL3353190 | US10023562, Example 12 | US1054413...)
Show SMILES CC(C)Nc1cc(Nc2ncc(cc2Cl)C#N)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r|
Show InChI InChI=1S/C20H24ClFN6O2/c1-11(2)27-15-6-17(28-18-14(21)5-12(7-23)8-25-18)24-9-13(15)19(29)26-10-16(22)20(3,4)30/h5-6,8-9,11,16,30H,10H2,1-4H3,(H,26,29)(H2,24,25,27,28)/t16-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.90n/an/an/an/a7.225



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...


US Patent US10023562 (2018)


BindingDB Entry DOI: 10.7270/Q2ZS2ZJR
More data for this
Ligand-Target Pair