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PubMed code 18482836

Compile data set for download or QSAR
Found 14 hits of Enzyme Inhibition Constant Data   
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
Mitogen-activated protein kinase 10


(Homo sapiens (Human))		BDBM50271563
PNG
(CHEMBL482708 | N-cyclohexyl-4-(H-imidazo[1,2-a]pyr...)
Show SMILES CN(C1CCCCC1)c1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C18H21N5/c1-22(14-7-3-2-4-8-14)18-19-11-10-15(21-18)16-13-20-17-9-5-6-12-23(16)17/h5-6,9-14H,2-4,7-8H2,1H3
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n/an/a 3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50240128
PNG
(6-(H-imidazo[1,2-a]pyridin-3-yl)-N-(piperidin-4-yl...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C17H19N5/c1-2-11-22-15(12-19-17(22)6-1)14-4-3-5-16(21-14)20-13-7-9-18-10-8-13/h1-6,11-13,18H,7-10H2,(H,20,21)
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n/an/a 35n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50240127
PNG
(6-(1H-benzo[d]imidazol-1-yl)-N-(piperidin-4-yl)pyr...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-n1cnc2ccccc12
Show InChI InChI=1S/C17H19N5/c1-2-5-15-14(4-1)19-12-22(15)17-7-3-6-16(21-17)20-13-8-10-18-11-9-13/h1-7,12-13,18H,8-11H2,(H,20,21)
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n/an/a 70n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271525
PNG
(4-(H-imidazo[1,2-a]pyridin-3-yl)-N-methyl-N-(piper...)
Show SMILES CN(C1CCNCC1)c1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C17H20N6/c1-22(13-5-8-18-9-6-13)17-19-10-7-14(21-17)15-12-20-16-4-2-3-11-23(15)16/h2-4,7,10-13,18H,5-6,8-9H2,1H3
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n/an/a 200n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50240093
PNG
(4-(H-imidazo[1,2-a]pyridin-3-yl)-N-(piperidin-4-yl...)
Show SMILES C1CC(CCN1)Nc1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C16H18N6/c1-2-10-22-14(11-19-15(22)3-1)13-6-9-18-16(21-13)20-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2,(H,18,20,21)
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n/an/a 216n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))		BDBM50271524
PNG
(2-(4-(4-(H-imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-...)
Show SMILES CNC(=O)CN1CCC(CC1)Nc1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C19H23N7O/c1-20-18(27)13-25-10-6-14(7-11-25)23-19-21-8-5-15(24-19)16-12-22-17-4-2-3-9-26(16)17/h2-5,8-9,12,14H,6-7,10-11,13H2,1H3,(H,20,27)(H,21,23,24)
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n/an/a 270n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK3 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271563
PNG
(CHEMBL482708 | N-cyclohexyl-4-(H-imidazo[1,2-a]pyr...)
Show SMILES CN(C1CCCCC1)c1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C18H21N5/c1-22(14-7-3-2-4-8-14)18-19-11-10-15(21-18)16-13-20-17-9-5-6-12-23(16)17/h5-6,9-14H,2-4,7-8H2,1H3
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n/an/a 400n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271602
PNG
(6-(1H-indazol-3-yl)-N-(piperidin-4-yl)pyridin-2-am...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-c1n[nH]c2ccccc12
Show InChI InChI=1S/C17H19N5/c1-2-5-14-13(4-1)17(22-21-14)15-6-3-7-16(20-15)19-12-8-10-18-11-9-12/h1-7,12,18H,8-11H2,(H,19,20)(H,21,22)
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n/an/a 456n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271562
PNG
(3-(2-(piperidin-4-yloxy)pyrimidin-4-yl)H-imidazo[1...)
Show SMILES C1CC(CCN1)Oc1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C16H17N5O/c1-2-10-21-14(11-19-15(21)3-1)13-6-9-18-16(20-13)22-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2
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n/an/a 1.19E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 9


(Homo sapiens (Human))		BDBM50271602
PNG
(6-(1H-indazol-3-yl)-N-(piperidin-4-yl)pyridin-2-am...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-c1n[nH]c2ccccc12
Show InChI InChI=1S/C17H19N5/c1-2-5-14-13(4-1)17(22-21-14)15-6-3-7-16(20-15)19-12-8-10-18-11-9-12/h1-7,12,18H,8-11H2,(H,19,20)(H,21,22)
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n/an/a 1.76E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK2 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271603
PNG
(6-(isoquinolin-4-yl)-N-(piperidin-4-yl)pyridin-2-a...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-c1cncc2ccccc12
Show InChI InChI=1S/C19H20N4/c1-2-5-16-14(4-1)12-21-13-17(16)18-6-3-7-19(23-18)22-15-8-10-20-11-9-15/h1-7,12-13,15,20H,8-11H2,(H,22,23)
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n/an/a 1.93E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))		BDBM50271602
PNG
(6-(1H-indazol-3-yl)-N-(piperidin-4-yl)pyridin-2-am...)
Show SMILES C1CC(CCN1)Nc1cccc(n1)-c1n[nH]c2ccccc12
Show InChI InChI=1S/C17H19N5/c1-2-5-14-13(4-1)17(22-21-14)15-6-3-7-16(20-15)19-12-8-10-18-11-9-12/h1-7,12,18H,8-11H2,(H,19,20)(H,21,22)
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n/an/a 2.08E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK1 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))		BDBM50271524
PNG
(2-(4-(4-(H-imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-...)
Show SMILES CNC(=O)CN1CCC(CC1)Nc1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C19H23N7O/c1-20-18(27)13-25-10-6-14(7-11-25)23-19-21-8-5-15(24-19)16-12-22-17-4-2-3-9-26(16)17/h2-5,8-9,12,14H,6-7,10-11,13H2,1H3,(H,20,27)(H,21,23,24)
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n/an/a 3.00E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of IRAK4 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))		BDBM50240093
PNG
(4-(H-imidazo[1,2-a]pyridin-3-yl)-N-(piperidin-4-yl...)
Show SMILES C1CC(CCN1)Nc1nccc(n1)-c1cnc2ccccn12
Show InChI InChI=1S/C16H18N6/c1-2-10-22-14(11-19-15(22)3-1)13-6-9-18-16(21-13)20-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2,(H,18,20,21)
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n/an/a 3.80E+3n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK1 (unknown origin)

Bioorg Med Chem Lett 18: 3291-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.039
BindingDB Entry DOI: 10.7270/Q2NZ87FX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%