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Compile Data Set for Download or QSAR

Found 58 hits with Last Name = 'bagley' and Initial = 'mc'   
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
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50411445
PNG
(CHEMBL235658)
Show SMILES Oc1ccc(NC(=O)CCCc2ccc(cc2)-c2ccccc2F)cc1
Show InChI InChI=1S/C22H20FNO2/c23-21-6-2-1-5-20(21)17-10-8-16(9-11-17)4-3-7-22(26)24-18-12-14-19(25)15-13-18/h1-2,5-6,8-15,25H,3-4,7H2,(H,24,26)
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330n/an/an/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human TERT immortalised HCA2 cells assessed as inhibition of anisomycin-induced HSP27 phosphorylation at 2.5 uM by ELISA


Bioorg Med Chem Lett 17: 6832-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.10.036
BindingDB Entry DOI: 10.7270/Q2W095P4
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM13533
PNG
(1-[2-(4-methylphenyl)-5-tert-butyl-pyrazol-3-yl]-3...)
Show SMILES Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Show InChI InChI=1S/C31H37N5O3/c1-22-9-11-23(12-10-22)36-29(21-28(34-36)31(2,3)4)33-30(37)32-26-13-14-27(25-8-6-5-7-24(25)26)39-20-17-35-15-18-38-19-16-35/h5-14,21H,15-20H2,1-4H3,(H2,32,33,37)
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n/an/a 7.70n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length p38alpha (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 17n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length p38beta (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556598
PNG
(CHEMBL4778587)
Show SMILES CCCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556602
PNG
(CHEMBL4798320)
Show SMILES CCC(C)NC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556609
PNG
(CHEMBL4740565)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1ccc(F)cc1 |r|
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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556618
PNG
(CHEMBL4745922)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1ccncc1 |r|
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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556596
PNG
(CHEMBL4784528)
Show SMILES CNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556620
PNG
(CHEMBL4779203)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1ccccn1 |r|
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n/an/a 25n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556619
PNG
(CHEMBL4795752)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1cccnc1 |r|
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n/an/a 33n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556599
PNG
(CHEMBL4797026)
Show SMILES CCCCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 34n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50505906
PNG
(CHEMBL3939964)
Show SMILES NC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
Show InChI InChI=1S/C28H34N6O3/c29-25-23(18-32-34(25)22-9-5-2-6-10-22)28(37)31-17-20-11-14-21(15-12-20)27(36)33-24(26(30)35)16-13-19-7-3-1-4-8-19/h2,5-6,9-12,14-15,18-19,24H,1,3-4,7-8,13,16-17,29H2,(H2,30,35)(H,31,37)(H,33,36)/t24-/m0/s1
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n/an/a 38n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556603
PNG
(CHEMBL4789011)
Show SMILES CCC(CC)NC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 38n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556604
PNG
(CHEMBL4790863)
Show SMILES CCC(CO)NC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 38n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556612
PNG
(CHEMBL4793252)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1cc(F)cc(F)c1 |r|
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n/an/a 41n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556607
PNG
(CHEMBL4796755)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCOCC1 |r|
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n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556606
PNG
(CHEMBL4749084)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NC1CCCCC1 |r|
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n/an/a 47n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556621
PNG
(CHEMBL4746375)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1cccs1 |r|
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n/an/a 81n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556608
PNG
(CHEMBL4792880)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCNCC1 |r|
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n/an/a 81n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556605
PNG
(CHEMBL4784037)
Show SMILES CC(C)CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 94n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556611
PNG
(CHEMBL4755890)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1ccc(Br)cc1 |r|
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n/an/a 94n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556610
PNG
(CHEMBL4744966)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1ccc(Cl)cc1 |r|
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n/an/a 107n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556617
PNG
(CHEMBL4764177)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCCc1ccc(Cl)cc1 |r|
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n/an/a 144n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM15754
PNG
((2S)-3-(3-{[5-amino-1-(4-fluorophenyl)-1H-pyrazol-...)
Show SMILES Nc1c(cnn1-c1ccc(F)cc1)C(=O)c1cccc(OC[C@@H](O)CO)c1 |r|
Show InChI InChI=1S/C19H18FN3O4/c20-13-4-6-14(7-5-13)23-19(21)17(9-22-23)18(26)12-2-1-3-16(8-12)27-11-15(25)10-24/h1-9,15,24-25H,10-11,21H2/t15-/m0/s1
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n/an/a 180n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of p38alpha in hTERT-immortalized human HCA2 cells assessed as decrease in phosphorylated HSP27 level by ELISA in presence of anisomycin


Bioorg Med Chem Lett 18: 3745-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.037
BindingDB Entry DOI: 10.7270/Q2BG2NSG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM15754
PNG
((2S)-3-(3-{[5-amino-1-(4-fluorophenyl)-1H-pyrazol-...)
Show SMILES Nc1c(cnn1-c1ccc(F)cc1)C(=O)c1cccc(OC[C@@H](O)CO)c1 |r|
Show InChI InChI=1S/C19H18FN3O4/c20-13-4-6-14(7-5-13)23-19(21)17(9-22-23)18(26)12-2-1-3-16(8-12)27-11-15(25)10-24/h1-9,15,24-25H,10-11,21H2/t15-/m0/s1
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n/an/a 250n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of p38alpha-induced TNFalpha production in human THP1 cells


Bioorg Med Chem Lett 18: 3745-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.037
BindingDB Entry DOI: 10.7270/Q2BG2NSG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556616
PNG
(CHEMBL4750197)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1ccc(Cl)cc1 |r|
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n/an/a 287n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM15754
PNG
((2S)-3-(3-{[5-amino-1-(4-fluorophenyl)-1H-pyrazol-...)
Show SMILES Nc1c(cnn1-c1ccc(F)cc1)C(=O)c1cccc(OC[C@@H](O)CO)c1 |r|
Show InChI InChI=1S/C19H18FN3O4/c20-13-4-6-14(7-5-13)23-19(21)17(9-22-23)18(26)12-2-1-3-16(8-12)27-11-15(25)10-24/h1-9,15,24-25H,10-11,21H2/t15-/m0/s1
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n/an/a 400n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin)-mediated IL1beta production in peripheral mononucleocytes


Bioorg Med Chem Lett 18: 3745-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.037
BindingDB Entry DOI: 10.7270/Q2BG2NSG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556625
PNG
(CHEMBL4780033)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCN(CC1)c1nc2ccccc2o1 |r|
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n/an/a 462n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM15754
PNG
((2S)-3-(3-{[5-amino-1-(4-fluorophenyl)-1H-pyrazol-...)
Show SMILES Nc1c(cnn1-c1ccc(F)cc1)C(=O)c1cccc(OC[C@@H](O)CO)c1 |r|
Show InChI InChI=1S/C19H18FN3O4/c20-13-4-6-14(7-5-13)23-19(21)17(9-22-23)18(26)12-2-1-3-16(8-12)27-11-15(25)10-24/h1-9,15,24-25H,10-11,21H2/t15-/m0/s1
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n/an/a 500n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of p38alpha (unknown origin)-mediated TNFalpha production in peripheral mononucleocytes


Bioorg Med Chem Lett 18: 3745-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.037
BindingDB Entry DOI: 10.7270/Q2BG2NSG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556615
PNG
(CHEMBL4760071)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)NCc1ccccc1 |r|
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n/an/a 543n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556624
PNG
(CHEMBL4787756)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCN(CC1)c1nc2ccccc2s1 |r|
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n/an/a 1.04E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 20


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 1.70E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length ZAK (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556622
PNG
(CHEMBL4778098)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCN(CC1)c1ccc(Cl)cc1 |r|
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n/an/a 1.77E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556613
PNG
(CHEMBL4794691)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1cc(Cl)cc(Cl)c1 |r|
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n/an/a 1.99E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556601
PNG
(CHEMBL4764492)
Show SMILES CCCCCCCCCCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 2.07E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556623
PNG
(CHEMBL4761242)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N1CCN(CC1)c1ccc(Br)cc1 |r|
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n/an/a 2.39E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50225787
PNG
(2,4-diamino-6,7-dihydroxy-10H-9-oxa-1-aza-anthrace...)
Show SMILES Nc1nc2Oc3cc(O)c(O)cc3Cc2c(N)c1C#N
Show InChI InChI=1S/C13H10N4O3/c14-4-7-11(15)6-1-5-2-8(18)9(19)3-10(5)20-13(6)17-12(7)16/h2-3,18-19H,1H2,(H4,15,16,17)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human TERT immortalised HCA2 cells assessed as inhibition of anisomycin-induced HSP27 phosphorylation by ELISA


Bioorg Med Chem Lett 17: 6832-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.10.036
BindingDB Entry DOI: 10.7270/Q2W095P4
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556614
PNG
(CHEMBL4794195)
Show SMILES Nc1c(cnn1-c1ccccc1)C(=O)NCc1ccc(cc1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)Nc1cc(Br)cc(Br)c1 |r|
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n/an/a 2.83E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Discoidin domain-containing receptor 2


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length DDR2 (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Epithelial discoidin domain-containing receptor 1


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 4.19E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length DDR1 (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 4


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 5.80E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length MAP3K4 (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50556600
PNG
(CHEMBL4777896)
Show SMILES CCCCCCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 9.52E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length human MAPK14 expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a 1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length FGFR3 G6973C mutant (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a>2.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length FLT3 D835Y mutant (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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n/an/a>2.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length FLT3 K663Q mutant (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
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antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length non-phosphorylated ABL1 Q252H mutant (unknown origin) expressed in HEK293T cells after 2 hrs by Na...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase STK11


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length STK11 (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
Ephrin type-A receptor 1


(Homo sapiens (Human))
BDBM50556597
PNG
(CHEMBL4756586)
Show SMILES CCNC(=O)[C@H](CCC1CCCCC1)NC(=O)c1ccc(CNC(=O)c2cnn(c2N)-c2ccccc2)cc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal NanoLuc-fused full length EPHA1 (unknown origin) expressed in HEK293T cells after 2 hrs by NanoBRET assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112721
BindingDB Entry DOI: 10.7270/Q24X5CGW
More data for this
Ligand-Target Pair
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