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PubMed code 24813737

Compile data set for download or QSAR
Found 107 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 1


(Homo sapiens (Human))
BDBM50021714
PNG
(CHEMBL3298418)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccnc(C)c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H22Cl2N6O/c1-13-9-17(5-7-25-13)28-21-26-11-16-6-8-30(12-20(16)29-21)22(31)27-14(2)15-3-4-18(23)19(24)10-15/h3-5,7,9-11,14H,6,8,12H2,1-2H3,(H,27,31)(H,25,26,28,29)/t14-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021719
PNG
(CHEMBL3298982)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25Cl2N5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021721
PNG
(CHEMBL3298984)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O2/c1-13(14-2-3-17(22)18(23)10-14)25-21(29)28-7-4-15-11-24-20(27-19(15)12-28)26-16-5-8-30-9-6-16/h2-3,10-11,13,16H,4-9,12H2,1H3,(H,25,29)(H,24,26,27)/t13-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021707
PNG
(CHEMBL3298985)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C23H27ClN6O2/c1-2-20(15-3-4-16(12-25)19(24)11-15)29-23(31)30-8-5-17-13-26-22(28-21(17)14-30)27-18-6-9-32-10-7-18/h3-4,11,13,18,20H,2,5-10,14H2,1H3,(H,29,31)(H,26,27,28)/t20-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021716
PNG
(CHEMBL3298420)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccn[nH]3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-14(20)15(21)8-12)24-19(29)28-7-5-13-9-22-18(25-16(13)10-28)26-17-4-6-23-27-17/h2-4,6,8-9,11H,5,7,10H2,1H3,(H,24,29)(H2,22,23,25,26,27)/t11-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021709
PNG
(CHEMBL3298308)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23Cl2N5O2/c1-11(10-27)23-18-22-8-14-5-6-26(9-17(14)25-18)19(28)24-12(2)13-3-4-15(20)16(21)7-13/h3-4,7-8,11-12,27H,5-6,9-10H2,1-2H3,(H,24,28)(H,22,23,25)/t11-,12+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021715
PNG
(CHEMBL3298419)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3cn[nH]c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-15(20)16(21)6-12)25-19(29)28-5-4-13-7-22-18(27-17(13)10-28)26-14-8-23-24-9-14/h2-3,6-9,11H,4-5,10H2,1H3,(H,23,24)(H,25,29)(H,22,26,27)/t11-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021717
PNG
(CHEMBL3298414)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-9-13(1-2-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021713
PNG
(CHEMBL3298312)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C21H28ClN5O3/c1-4-17(14-5-6-19(30-3)16(22)9-14)26-21(29)27-8-7-15-10-23-20(24-13(2)12-28)25-18(15)11-27/h5-6,9-10,13,17,28H,4,7-8,11-12H2,1-3H3,(H,26,29)(H,23,24,25)/t13-,17+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021708
PNG
(CHEMBL3298199)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CCO[C@@H](CO)C3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H27Cl2N5O3/c1-13(14-2-3-18(23)19(24)8-14)26-22(31)29-6-4-15-10-25-21(28-20(15)11-29)27-16-5-7-32-17(9-16)12-30/h2-3,8,10,13,16-17,30H,4-7,9,11-12H2,1H3,(H,26,31)(H,25,27,28)/t13-,16+,17-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021720
PNG
(CHEMBL3298983)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc2cc[nH]c2c1 |r|
Show InChI InChI=1S/C23H28N6O2/c1-15(17-3-2-16-4-8-24-20(16)12-17)26-23(30)29-9-5-18-13-25-22(28-21(18)14-29)27-19-6-10-31-11-7-19/h2-4,8,12-13,15,19,24H,5-7,9-11,14H2,1H3,(H,26,30)(H,25,27,28)/t15-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021754
PNG
(CHEMBL3298417)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CC[C@H](O)C3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-7-12(1-4-17(16)23)19(11-29)27-21(31)28-6-5-13-9-24-20(26-18(13)10-28)25-14-2-3-15(30)8-14/h1,4,7,9,14-15,19,29-30H,2-3,5-6,8,10-11H2,(H,27,31)(H,24,25,26)/t14-,15-,19+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021708
PNG
(CHEMBL3298199)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CCO[C@@H](CO)C3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H27Cl2N5O3/c1-13(14-2-3-18(23)19(24)8-14)26-22(31)29-6-4-15-10-25-21(28-20(15)11-29)27-16-5-7-32-17(9-16)12-30/h2-3,8,10,13,16-17,30H,4-7,9,11-12H2,1H3,(H,26,31)(H,25,27,28)/t13-,16+,17-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021711
PNG
(CHEMBL3298310)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25Cl2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021707
PNG
(CHEMBL3298985)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C23H27ClN6O2/c1-2-20(15-3-4-16(12-25)19(24)11-15)29-23(31)30-8-5-17-13-26-22(28-21(17)14-30)27-18-6-9-32-10-7-18/h3-4,11,13,18,20H,2,5-10,14H2,1H3,(H,29,31)(H,26,27,28)/t20-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021736
PNG
(CHEMBL3297855 | US9133187, II-7)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CN)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H24ClFN6O/c1-11(2)24-18-23-9-13-5-6-27(10-17(13)25-18)19(28)26-16(8-22)12-3-4-15(21)14(20)7-12/h3-4,7,9,11,16H,5-6,8,10,22H2,1-2H3,(H,26,28)(H,23,24,25)/t16-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021733
PNG
(CHEMBL3297852)
Show SMILES CC[C@H](O)[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H27ClFN5O2/c1-4-18(29)19(13-5-6-16(23)15(22)9-13)27-21(30)28-8-7-14-10-24-20(25-12(2)3)26-17(14)11-28/h5-6,9-10,12,18-19,29H,4,7-8,11H2,1-3H3,(H,27,30)(H,24,25,26)/t18-,19-/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021718
PNG
(CHEMBL3298678)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021731
PNG
(CHEMBL3297850)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H]([C@@H](C)O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-11(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(12(3)28)13-4-5-16(22)15(21)8-13/h4-5,8-9,11-12,18,28H,6-7,10H2,1-3H3,(H,26,29)(H,23,24,25)/t12-,18-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021712
PNG
(CHEMBL3298311)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H23F4N5O2/c1-11(10-30)26-18-25-8-14-5-6-29(9-17(14)28-18)19(31)27-12(2)13-3-4-15(16(21)7-13)20(22,23)24/h3-4,7-8,11-12,30H,5-6,9-10H2,1-2H3,(H,27,31)(H,25,26,28)/t11-,12+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021744
PNG
(CHEMBL3298415)
Show SMILES CC(CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23ClFN5O3/c1-11(9-27)23-18-22-7-13-4-5-26(8-16(13)24-18)19(29)25-17(10-28)12-2-3-15(21)14(20)6-12/h2-3,6-7,11,17,27-28H,4-5,8-10H2,1H3,(H,25,29)(H,22,23,24)/t11?,17-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021760
PNG
(CHEMBL3298566)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(Nc3ccc(F)cc3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C22H20ClF2N5O2/c23-17-9-13(1-6-18(17)25)20(12-31)29-22(32)30-8-7-14-10-26-21(28-19(14)11-30)27-16-4-2-15(24)3-5-16/h1-6,9-10,20,31H,7-8,11-12H2,(H,29,32)(H,26,27,28)/t20-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021710
PNG
(CHEMBL3298309)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C20H25F2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021737
PNG
(CHEMBL3297856)
Show SMILES CNC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H26ClFN6O/c1-12(2)25-19-24-9-14-6-7-28(11-18(14)26-19)20(29)27-17(10-23-3)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,17,23H,6-7,10-11H2,1-3H3,(H,27,29)(H,24,25,26)/t17-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021743
PNG
(CHEMBL3298307)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCCC3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O2/c22-16-9-13(5-6-17(16)23)19(12-29)27-21(30)28-8-7-14-10-24-20(26-18(14)11-28)25-15-3-1-2-4-15/h5-6,9-10,15,19,29H,1-4,7-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021715
PNG
(CHEMBL3298419)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3cn[nH]c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-15(20)16(21)6-12)25-19(29)28-5-4-13-7-22-18(27-17(13)10-28)26-14-8-23-24-9-14/h2-3,6-9,11H,4-5,10H2,1H3,(H,23,24)(H,25,29)(H,22,26,27)/t11-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021730
PNG
(CHEMBL3297849)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23ClFN5O2/c1-11(2)23-18-22-8-13-5-6-26(9-16(13)24-18)19(28)25-17(10-27)12-3-4-15(21)14(20)7-12/h3-4,7-8,11,17,27H,5-6,9-10H2,1-2H3,(H,25,28)(H,22,23,24)/t17-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021707
PNG
(CHEMBL3298985)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C23H27ClN6O2/c1-2-20(15-3-4-16(12-25)19(24)11-15)29-23(31)30-8-5-17-13-26-22(28-21(17)14-30)27-18-6-9-32-10-7-18/h3-4,11,13,18,20H,2,5-10,14H2,1H3,(H,29,31)(H,26,27,28)/t20-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021722
PNG
(CHEMBL3298565)
Show SMILES COc1ccc(CNC(=O)N2CCc3cnc(NC(C)C)nc3C2)cc1
Show InChI InChI=1S/C19H25N5O2/c1-13(2)22-18-20-11-15-8-9-24(12-17(15)23-18)19(25)21-10-14-4-6-16(26-3)7-5-14/h4-7,11,13H,8-10,12H2,1-3H3,(H,21,25)(H,20,22,23)
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n/an/a 4.40n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021732
PNG
(CHEMBL3297851 | US9133187, II-40)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H]([C@H](C)O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-11(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(12(3)28)13-4-5-16(22)15(21)8-13/h4-5,8-9,11-12,18,28H,6-7,10H2,1-3H3,(H,26,29)(H,23,24,25)/t12-,18+/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021766
PNG
(CHEMBL3298676)
Show SMILES Cn1cc(Nc2ncc3CCN(Cc3n2)C(=O)N[C@H](CO)c2ccc(F)c(Cl)c2)cn1 |r|
Show InChI InChI=1S/C20H21ClFN7O2/c1-28-9-14(8-24-28)25-19-23-7-13-4-5-29(10-17(13)26-19)20(31)27-18(11-30)12-2-3-16(22)15(21)6-12/h2-3,6-9,18,30H,4-5,10-11H2,1H3,(H,27,31)(H,23,25,26)/t18-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021739
PNG
(CHEMBL3297858 | US9133187, II-43)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CNS(C)(=O)=O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H26ClFN6O3S/c1-12(2)25-19-23-9-14-6-7-28(11-18(14)26-19)20(29)27-17(10-24-32(3,30)31)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,17,24H,6-7,10-11H2,1-3H3,(H,27,29)(H,23,25,26)/t17-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021708
PNG
(CHEMBL3298199)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CCO[C@@H](CO)C3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H27Cl2N5O3/c1-13(14-2-3-18(23)19(24)8-14)26-22(31)29-6-4-15-10-25-21(28-20(15)11-29)27-16-5-7-32-17(9-16)12-30/h2-3,8,10,13,16-17,30H,4-7,9,11-12H2,1H3,(H,26,31)(H,25,27,28)/t13-,16+,17-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021767
PNG
(CHEMBL3298677)
Show SMILES Cc1cc(Nc2ncc3CCN(Cc3n2)C(=O)N[C@H](CO)c2ccc(F)c(Cl)c2)ccn1 |r|
Show InChI InChI=1S/C22H22ClFN6O2/c1-13-8-16(4-6-25-13)27-21-26-10-15-5-7-30(11-19(15)28-21)22(32)29-20(12-31)14-2-3-18(24)17(23)9-14/h2-4,6,8-10,20,31H,5,7,11-12H2,1H3,(H,29,32)(H,25,26,27,28)/t20-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021738
PNG
(CHEMBL3297857)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CNCCO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H28ClFN6O2/c1-13(2)26-20-25-10-15-5-7-29(12-19(15)27-20)21(31)28-18(11-24-6-8-30)14-3-4-17(23)16(22)9-14/h3-4,9-10,13,18,24,30H,5-8,11-12H2,1-2H3,(H,28,31)(H,25,26,27)/t18-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021714
PNG
(CHEMBL3298418)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccnc(C)c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H22Cl2N6O/c1-13-9-17(5-7-25-13)28-21-26-11-16-6-8-30(12-20(16)29-21)22(31)27-14(2)15-3-4-18(23)19(24)10-15/h3-5,7,9-11,14H,6,8,12H2,1-2H3,(H,27,31)(H,25,26,28,29)/t14-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021742
PNG
(CHEMBL3298306)
Show SMILES OCCNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H21ClFN5O3/c19-13-7-11(1-2-14(13)20)16(10-27)24-18(28)25-5-3-12-8-22-17(21-4-6-26)23-15(12)9-25/h1-2,7-8,16,26-27H,3-6,9-10H2,(H,24,28)(H,21,22,23)/t16-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021718
PNG
(CHEMBL3298678)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021764
PNG
(CHEMBL3298568)
Show SMILES CCC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-3-12(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(11-28)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,18,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12?,18-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021734
PNG
(CHEMBL3297853)
Show SMILES COC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-12(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(28)26-18(11-29-3)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,18H,6-7,10-11H2,1-3H3,(H,26,28)(H,23,24,25)/t18-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021719
PNG
(CHEMBL3298982)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25Cl2N5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021721
PNG
(CHEMBL3298984)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O2/c1-13(14-2-3-17(22)18(23)10-14)25-21(29)28-7-4-15-11-24-20(27-19(15)12-28)26-16-5-8-30-9-6-16/h2-3,10-11,13,16H,4-9,12H2,1H3,(H,25,29)(H,24,26,27)/t13-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021711
PNG
(CHEMBL3298310)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25Cl2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021721
PNG
(CHEMBL3298984)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O2/c1-13(14-2-3-17(22)18(23)10-14)25-21(29)28-7-4-15-11-24-20(27-19(15)12-28)26-16-5-8-30-9-6-16/h2-3,10-11,13,16H,4-9,12H2,1H3,(H,25,29)(H,24,26,27)/t13-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021710
PNG
(CHEMBL3298309)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C20H25F2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021713
PNG
(CHEMBL3298312)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C21H28ClN5O3/c1-4-17(14-5-6-19(30-3)16(22)9-14)26-21(29)27-8-7-15-10-23-20(24-13(2)12-28)25-18(15)11-27/h5-6,9-10,13,17,28H,4,7-8,11-12H2,1-3H3,(H,26,29)(H,23,24,25)/t13-,17+/m0/s1
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n/an/a 14n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021717
PNG
(CHEMBL3298414)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-9-13(1-2-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021719
PNG
(CHEMBL3298982)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25Cl2N5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 17n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021741
PNG
(CHEMBL3298305)
Show SMILES CCNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H21ClFN5O2/c1-2-21-17-22-8-12-5-6-25(9-15(12)23-17)18(27)24-16(10-26)11-3-4-14(20)13(19)7-11/h3-4,7-8,16,26H,2,5-6,9-10H2,1H3,(H,24,27)(H,21,22,23)/t16-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021720
PNG
(CHEMBL3298983)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc2cc[nH]c2c1 |r|
Show InChI InChI=1S/C23H28N6O2/c1-15(17-3-2-16-4-8-24-20(16)12-17)26-23(30)29-9-5-18-13-25-22(28-21(18)14-29)27-19-6-10-31-11-7-19/h2-4,8,12-13,15,19,24H,5-7,9-11,14H2,1H3,(H,26,30)(H,25,27,28)/t15-/m1/s1
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n/an/a 21n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021709
PNG
(CHEMBL3298308)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23Cl2N5O2/c1-11(10-27)23-18-22-8-14-5-6-26(9-17(14)25-18)19(28)24-12(2)13-3-4-15(20)16(21)7-13/h3-4,7-8,11-12,27H,5-6,9-10H2,1-2H3,(H,24,28)(H,22,23,25)/t11-,12+/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021711
PNG
(CHEMBL3298310)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25Cl2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021714
PNG
(CHEMBL3298418)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccnc(C)c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C22H22Cl2N6O/c1-13-9-17(5-7-25-13)28-21-26-11-16-6-8-30(12-20(16)29-21)22(31)27-14(2)15-3-4-18(23)19(24)10-15/h3-5,7,9-11,14H,6,8,12H2,1-2H3,(H,27,31)(H,25,26,28,29)/t14-/m1/s1
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n/an/a 23n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021716
PNG
(CHEMBL3298420)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccn[nH]3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-14(20)15(21)8-12)24-19(29)28-7-5-13-9-22-18(25-16(13)10-28)26-17-4-6-23-27-17/h2-4,6,8-9,11H,5,7,10H2,1H3,(H,24,29)(H2,22,23,25,26,27)/t11-/m1/s1
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n/an/a 23n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021718
PNG
(CHEMBL3298678)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-2-1-13(9-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 25n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021762
PNG
(CHEMBL3298567 | US9133187, II-34)
Show SMILES Cc1noc(C)c1Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H22ClFN6O3/c1-11-19(12(2)32-28-11)27-20-24-8-14-5-6-29(9-17(14)25-20)21(31)26-18(10-30)13-3-4-16(23)15(22)7-13/h3-4,7-8,18,30H,5-6,9-10H2,1-2H3,(H,26,31)(H,24,25,27)/t18-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021715
PNG
(CHEMBL3298419)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3cn[nH]c3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-15(20)16(21)6-12)25-19(29)28-5-4-13-7-22-18(27-17(13)10-28)26-14-8-23-24-9-14/h2-3,6-9,11H,4-5,10H2,1H3,(H,23,24)(H,25,29)(H,22,26,27)/t11-/m1/s1
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n/an/a 35n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021745
PNG
(CHEMBL3298416)
Show SMILES CC(C)(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-20(2,3)26-18-23-9-13-6-7-27(10-16(13)24-18)19(29)25-17(11-28)12-4-5-15(22)14(21)8-12/h4-5,8-9,17,28H,6-7,10-11H2,1-3H3,(H,25,29)(H,23,24,26)/t17-/m1/s1
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n/an/a 41n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021716
PNG
(CHEMBL3298420)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(Nc3ccn[nH]3)nc2C1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H19Cl2N7O/c1-11(12-2-3-14(20)15(21)8-12)24-19(29)28-7-5-13-9-22-18(25-16(13)10-28)26-17-4-6-23-27-17/h2-4,6,8-9,11H,5,7,10H2,1H3,(H,24,29)(H2,22,23,25,26,27)/t11-/m1/s1
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n/an/a 43n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021740
PNG
(CHEMBL3298304)
Show SMILES CNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C17H19ClFN5O2/c1-20-16-21-7-11-4-5-24(8-14(11)22-16)17(26)23-15(9-25)10-2-3-13(19)12(18)6-10/h2-3,6-7,15,25H,4-5,8-9H2,1H3,(H,23,26)(H,20,21,22)/t15-/m1/s1
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n/an/a 43n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021717
PNG
(CHEMBL3298414)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-9-13(1-2-17(16)23)19(12-29)27-21(30)28-6-3-14-10-24-20(26-18(14)11-28)25-15-4-7-31-8-5-15/h1-2,9-10,15,19,29H,3-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 45n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021710
PNG
(CHEMBL3298309)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(F)c(F)c1 |r|
Show InChI InChI=1S/C20H25F2N5O2/c1-3-17(13-4-5-15(21)16(22)8-13)26-20(29)27-7-6-14-9-23-19(24-12(2)11-28)25-18(14)10-27/h4-5,8-9,12,17,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12-,17+/m0/s1
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n/an/a 51n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021729
PNG
(CHEMBL3297848)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(F)c(Cl)c1
Show InChI InChI=1S/C18H21ClFN5O/c1-11(2)23-17-21-9-13-5-6-25(10-16(13)24-17)18(26)22-8-12-3-4-15(20)14(19)7-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,22,26)(H,21,23,24)
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n/an/a 66n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021720
PNG
(CHEMBL3298983)
Show SMILES C[C@@H](NC(=O)N1CCc2cnc(NC3CCOCC3)nc2C1)c1ccc2cc[nH]c2c1 |r|
Show InChI InChI=1S/C23H28N6O2/c1-15(17-3-2-16-4-8-24-20(16)12-17)26-23(30)29-9-5-18-13-25-22(28-21(18)14-29)27-19-6-10-31-11-7-19/h2-4,8,12-13,15,19,24H,5-7,9-11,14H2,1H3,(H,26,30)(H,25,27,28)/t15-/m1/s1
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n/an/a 69n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021724
PNG
(CHEMBL3298672)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C18H22FN5O/c1-12(2)22-17-20-10-14-7-8-24(11-16(14)23-17)18(25)21-9-13-3-5-15(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 69n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021713
PNG
(CHEMBL3298312)
Show SMILES CC[C@@H](NC(=O)N1CCc2cnc(N[C@@H](C)CO)nc2C1)c1ccc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C21H28ClN5O3/c1-4-17(14-5-6-19(30-3)16(22)9-14)26-21(29)27-8-7-15-10-23-20(24-13(2)12-28)25-18(15)11-27/h5-6,9-10,13,17,28H,4,7-8,11-12H2,1-3H3,(H,26,29)(H,23,24,25)/t13-,17+/m0/s1
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n/an/a 71n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021728
PNG
(CHEMBL3297847)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(Cl)c(F)c1
Show InChI InChI=1S/C18H21ClFN5O/c1-11(2)23-17-21-9-13-5-6-25(10-16(13)24-17)18(26)22-8-12-3-4-14(19)15(20)7-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,22,26)(H,21,23,24)
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n/an/a 81n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021731
PNG
(CHEMBL3297850)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H]([C@@H](C)O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-11(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(12(3)28)13-4-5-16(22)15(21)8-13/h4-5,8-9,11-12,18,28H,6-7,10H2,1-3H3,(H,26,29)(H,23,24,25)/t12-,18-/m1/s1
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n/an/a 88n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021727
PNG
(CHEMBL3298894)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1cccc(Cl)c1
Show InChI InChI=1S/C18H22ClN5O/c1-12(2)22-17-20-10-14-6-7-24(11-16(14)23-17)18(25)21-9-13-4-3-5-15(19)8-13/h3-5,8,10,12H,6-7,9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 89n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021725
PNG
(CHEMBL3298673)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(Cl)cc1
Show InChI InChI=1S/C18H22ClN5O/c1-12(2)22-17-20-10-14-7-8-24(11-16(14)23-17)18(25)21-9-13-3-5-15(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 91n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021765
PNG
(CHEMBL3298675)
Show SMILES CC(=O)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H19ClFN5O3/c1-10(27)22-17-21-7-12-4-5-25(8-15(12)23-17)18(28)24-16(9-26)11-2-3-14(20)13(19)6-11/h2-3,6-7,16,26H,4-5,8-9H2,1H3,(H,24,28)(H,21,22,23,27)/t16-/m1/s1
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n/an/a 93n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021726
PNG
(CHEMBL3298674)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1cccc(F)c1
Show InChI InChI=1S/C18H22FN5O/c1-12(2)22-17-20-10-14-6-7-24(11-16(14)23-17)18(25)21-9-13-4-3-5-15(19)8-13/h3-5,8,10,12H,6-7,9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 93n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021709
PNG
(CHEMBL3298308)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23Cl2N5O2/c1-11(10-27)23-18-22-8-14-5-6-26(9-17(14)25-18)19(28)24-12(2)13-3-4-15(20)16(21)7-13/h3-4,7-8,11-12,27H,5-6,9-10H2,1-2H3,(H,24,28)(H,22,23,25)/t11-,12+/m0/s1
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n/an/a 104n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021722
PNG
(CHEMBL3298565)
Show SMILES COc1ccc(CNC(=O)N2CCc3cnc(NC(C)C)nc3C2)cc1
Show InChI InChI=1S/C19H25N5O2/c1-13(2)22-18-20-11-15-8-9-24(12-17(15)23-18)19(25)21-10-14-4-6-16(26-3)7-5-14/h4-7,11,13H,8-10,12H2,1-3H3,(H,21,25)(H,20,22,23)
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n/an/a 106n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021733
PNG
(CHEMBL3297852)
Show SMILES CC[C@H](O)[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H27ClFN5O2/c1-4-18(29)19(13-5-6-16(23)15(22)9-13)27-21(30)28-8-7-14-10-24-20(25-12(2)3)26-17(14)11-28/h5-6,9-10,12,18-19,29H,4,7-8,11H2,1-3H3,(H,27,30)(H,24,25,26)/t18-,19-/m0/s1
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n/an/a 108n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021712
PNG
(CHEMBL3298311)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H23F4N5O2/c1-11(10-30)26-18-25-8-14-5-6-29(9-17(14)28-18)19(31)27-12(2)13-3-4-15(16(21)7-13)20(22,23)24/h3-4,7-8,11-12,30H,5-6,9-10H2,1-2H3,(H,27,31)(H,25,26,28)/t11-,12+/m0/s1
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n/an/a 110n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021735
PNG
(CHEMBL3297854)
Show SMILES COCCOC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C22H29ClFN5O3/c1-14(2)26-21-25-11-16-6-7-29(12-19(16)27-21)22(30)28-20(13-32-9-8-31-3)15-4-5-18(24)17(23)10-15/h4-5,10-11,14,20H,6-9,12-13H2,1-3H3,(H,28,30)(H,25,26,27)/t20-/m1/s1
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n/an/a 122n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021737
PNG
(CHEMBL3297856)
Show SMILES CNC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H26ClFN6O/c1-12(2)25-19-24-9-14-6-7-28(11-18(14)26-19)20(29)27-17(10-23-3)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,17,23H,6-7,10-11H2,1-3H3,(H,27,29)(H,24,25,26)/t17-/m1/s1
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n/an/a 144n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021730
PNG
(CHEMBL3297849)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23ClFN5O2/c1-11(2)23-18-22-8-13-5-6-26(9-16(13)24-18)19(28)25-17(10-27)12-3-4-15(21)14(20)7-12/h3-4,7-8,11,17,27H,5-6,9-10H2,1-2H3,(H,25,28)(H,22,23,24)/t17-/m1/s1
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n/an/a 160n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021754
PNG
(CHEMBL3298417)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CC[C@H](O)C3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O3/c22-16-7-12(1-4-17(16)23)19(11-29)27-21(31)28-6-5-13-9-24-20(26-18(13)10-28)25-14-2-3-15(30)8-14/h1,4,7,9,14-15,19,29-30H,2-3,5-6,8,10-11H2,(H,27,31)(H,24,25,26)/t14-,15-,19+/m0/s1
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n/an/a 198n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021732
PNG
(CHEMBL3297851 | US9133187, II-40)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H]([C@H](C)O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-11(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(12(3)28)13-4-5-16(22)15(21)8-13/h4-5,8-9,11-12,18,28H,6-7,10H2,1-3H3,(H,26,29)(H,23,24,25)/t12-,18+/m0/s1
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n/an/a 200n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021766
PNG
(CHEMBL3298676)
Show SMILES Cn1cc(Nc2ncc3CCN(Cc3n2)C(=O)N[C@H](CO)c2ccc(F)c(Cl)c2)cn1 |r|
Show InChI InChI=1S/C20H21ClFN7O2/c1-28-9-14(8-24-28)25-19-23-7-13-4-5-29(10-17(13)26-19)20(31)27-18(11-30)12-2-3-16(22)15(21)6-12/h2-3,6-9,18,30H,4-5,10-11H2,1H3,(H,27,31)(H,23,25,26)/t18-/m1/s1
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n/an/a 247n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021723
PNG
(CHEMBL3298671)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C18H23N5O/c1-13(2)21-17-19-11-15-8-9-23(12-16(15)22-17)18(24)20-10-14-6-4-3-5-7-14/h3-7,11,13H,8-10,12H2,1-2H3,(H,20,24)(H,19,21,22)
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n/an/a 283n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged ERK2 expressed in Escherichia coli using S/T17 as substrate after 30 mins by spectrophotometr...


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021743
PNG
(CHEMBL3298307)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(NC3CCCC3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H25ClFN5O2/c22-16-9-13(5-6-17(16)23)19(12-29)27-21(30)28-8-7-14-10-24-20(26-18(14)11-28)25-15-3-1-2-4-15/h5-6,9-10,15,19,29H,1-4,7-8,11-12H2,(H,27,30)(H,24,25,26)/t19-/m1/s1
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n/an/a 330n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021760
PNG
(CHEMBL3298566)
Show SMILES OC[C@@H](NC(=O)N1CCc2cnc(Nc3ccc(F)cc3)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C22H20ClF2N5O2/c23-17-9-13(1-6-18(17)25)20(12-31)29-22(32)30-8-7-14-10-26-21(28-19(14)11-30)27-16-4-2-15(24)3-5-16/h1-6,9-10,20,31H,7-8,11-12H2,(H,29,32)(H,26,27,28)/t20-/m1/s1
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n/an/a 348n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021736
PNG
(CHEMBL3297855 | US9133187, II-7)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CN)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H24ClFN6O/c1-11(2)24-18-23-9-13-5-6-27(10-17(13)25-18)19(28)26-16(8-22)12-3-4-15(21)14(20)7-12/h3-4,7,9,11,16H,5-6,8,10,22H2,1-2H3,(H,26,28)(H,23,24,25)/t16-/m1/s1
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n/an/a 356n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021734
PNG
(CHEMBL3297853)
Show SMILES COC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-12(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(28)26-18(11-29-3)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,18H,6-7,10-11H2,1-3H3,(H,26,28)(H,23,24,25)/t18-/m1/s1
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Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021767
PNG
(CHEMBL3298677)
Show SMILES Cc1cc(Nc2ncc3CCN(Cc3n2)C(=O)N[C@H](CO)c2ccc(F)c(Cl)c2)ccn1 |r|
Show InChI InChI=1S/C22H22ClFN6O2/c1-13-8-16(4-6-25-13)27-21-26-10-15-5-7-30(11-19(15)28-21)22(32)29-20(12-31)14-2-3-18(24)17(23)9-14/h2-4,6,8-10,20,31H,5,7,11-12H2,1H3,(H,29,32)(H,25,26,27,28)/t20-/m1/s1
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n/an/a 445n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021744
PNG
(CHEMBL3298415)
Show SMILES CC(CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23ClFN5O3/c1-11(9-27)23-18-22-7-13-4-5-26(8-16(13)24-18)19(29)25-17(10-28)12-2-3-15(21)14(20)6-12/h2-3,6-7,11,17,27-28H,4-5,8-10H2,1H3,(H,25,29)(H,22,23,24)/t11?,17-/m1/s1
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n/an/a 473n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021764
PNG
(CHEMBL3298568)
Show SMILES CCC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-3-12(2)24-19-23-9-14-6-7-27(10-17(14)25-19)20(29)26-18(11-28)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,18,28H,3,6-7,10-11H2,1-2H3,(H,26,29)(H,23,24,25)/t12?,18-/m1/s1
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n/an/a 513n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021741
PNG
(CHEMBL3298305)
Show SMILES CCNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H21ClFN5O2/c1-2-21-17-22-8-12-5-6-25(9-15(12)23-17)18(27)24-16(10-26)11-3-4-14(20)13(19)7-11/h3-4,7-8,16,26H,2,5-6,9-10H2,1H3,(H,24,27)(H,21,22,23)/t16-/m1/s1
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n/an/a 753n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50021712
PNG
(CHEMBL3298311)
Show SMILES C[C@@H](CO)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](C)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H23F4N5O2/c1-11(10-30)26-18-25-8-14-5-6-29(9-17(14)28-18)19(31)27-12(2)13-3-4-15(16(21)7-13)20(22,23)24/h3-4,7-8,11-12,30H,5-6,9-10H2,1-2H3,(H,27,31)(H,25,26,28)/t11-,12+/m0/s1
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n/an/a 821n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of Cdk2 (unknown origin)


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021739
PNG
(CHEMBL3297858 | US9133187, II-43)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CNS(C)(=O)=O)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H26ClFN6O3S/c1-12(2)25-19-23-9-14-6-7-28(11-18(14)26-19)20(29)27-17(10-24-32(3,30)31)13-4-5-16(22)15(21)8-13/h4-5,8-9,12,17,24H,6-7,10-11H2,1-3H3,(H,27,29)(H,23,25,26)/t17-/m1/s1
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n/an/a 917n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021729
PNG
(CHEMBL3297848)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(F)c(Cl)c1
Show InChI InChI=1S/C18H21ClFN5O/c1-11(2)23-17-21-9-13-5-6-25(10-16(13)24-17)18(26)22-8-12-3-4-15(20)14(19)7-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,22,26)(H,21,23,24)
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n/an/a 1.22E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021728
PNG
(CHEMBL3297847)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(Cl)c(F)c1
Show InChI InChI=1S/C18H21ClFN5O/c1-11(2)23-17-21-9-13-5-6-25(10-16(13)24-17)18(26)22-8-12-3-4-14(19)15(20)7-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,22,26)(H,21,23,24)
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n/an/a 1.63E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021727
PNG
(CHEMBL3298894)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1cccc(Cl)c1
Show InChI InChI=1S/C18H22ClN5O/c1-12(2)22-17-20-10-14-6-7-24(11-16(14)23-17)18(25)21-9-13-4-3-5-15(19)8-13/h3-5,8,10,12H,6-7,9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 1.86E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021735
PNG
(CHEMBL3297854)
Show SMILES COCCOC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C22H29ClFN5O3/c1-14(2)26-21-25-11-16-6-7-29(12-19(16)27-21)22(30)28-20(13-32-9-8-31-3)15-4-5-18(24)17(23)10-15/h4-5,10-11,14,20H,6-9,12-13H2,1-3H3,(H,28,30)(H,25,26,27)/t20-/m1/s1
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n/an/a 2.11E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021725
PNG
(CHEMBL3298673)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(Cl)cc1
Show InChI InChI=1S/C18H22ClN5O/c1-12(2)22-17-20-10-14-7-8-24(11-16(14)23-17)18(25)21-9-13-3-5-15(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 2.14E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021740
PNG
(CHEMBL3298304)
Show SMILES CNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C17H19ClFN5O2/c1-20-16-21-7-11-4-5-24(8-14(11)22-16)17(26)23-15(9-25)10-2-3-13(19)12(18)6-10/h2-3,6-7,15,25H,4-5,8-9H2,1H3,(H,23,26)(H,20,21,22)/t15-/m1/s1
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n/an/a 2.26E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021742
PNG
(CHEMBL3298306)
Show SMILES OCCNc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H21ClFN5O3/c19-13-7-11(1-2-14(13)20)16(10-27)24-18(28)25-5-3-12-8-22-17(21-4-6-26)23-15(12)9-25/h1-2,7-8,16,26-27H,3-6,9-10H2,(H,24,28)(H,21,22,23)/t16-/m1/s1
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n/an/a 2.45E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021726
PNG
(CHEMBL3298674)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1cccc(F)c1
Show InChI InChI=1S/C18H22FN5O/c1-12(2)22-17-20-10-14-6-7-24(11-16(14)23-17)18(25)21-9-13-4-3-5-15(19)8-13/h3-5,8,10,12H,6-7,9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 2.61E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021738
PNG
(CHEMBL3297857)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CNCCO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H28ClFN6O2/c1-13(2)26-20-25-10-15-5-7-29(12-19(15)27-20)21(31)28-18(11-24-6-8-30)14-3-4-17(23)16(22)9-14/h3-4,9-10,13,18,24,30H,5-8,11-12H2,1-2H3,(H,28,31)(H,25,26,27)/t18-/m1/s1
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n/an/a 2.76E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021745
PNG
(CHEMBL3298416)
Show SMILES CC(C)(C)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C20H25ClFN5O2/c1-20(2,3)26-18-23-9-13-6-7-27(10-16(13)24-18)19(29)25-17(11-28)12-4-5-15(22)14(21)8-12/h4-5,8-9,17,28H,6-7,10-11H2,1-3H3,(H,25,29)(H,23,24,26)/t17-/m1/s1
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n/an/a 3.01E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021723
PNG
(CHEMBL3298671)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C18H23N5O/c1-13(2)21-17-19-11-15-8-9-23(12-16(15)22-17)18(24)20-10-14-6-4-3-5-7-14/h3-7,11,13H,8-10,12H2,1-2H3,(H,20,24)(H,19,21,22)
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n/an/a 4.38E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021724
PNG
(CHEMBL3298672)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C18H22FN5O/c1-12(2)22-17-20-10-14-7-8-24(11-16(14)23-17)18(25)21-9-13-3-5-15(19)6-4-13/h3-6,10,12H,7-9,11H2,1-2H3,(H,21,25)(H,20,22,23)
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n/an/a 6.62E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021765
PNG
(CHEMBL3298675)
Show SMILES CC(=O)Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C18H19ClFN5O3/c1-10(27)22-17-21-7-12-4-5-25(8-15(12)23-17)18(28)24-16(9-26)11-2-3-14(20)13(19)6-11/h2-3,6-7,16,26H,4-5,8-9H2,1H3,(H,24,28)(H,21,22,23,27)/t16-/m1/s1
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n/an/a 7.44E+3n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50021762
PNG
(CHEMBL3298567 | US9133187, II-34)
Show SMILES Cc1noc(C)c1Nc1ncc2CCN(Cc2n1)C(=O)N[C@H](CO)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C21H22ClFN6O3/c1-11-19(12(2)32-28-11)27-20-24-8-14-5-6-29(9-17(14)25-20)21(31)26-18(10-30)13-3-4-16(23)15(22)7-13/h3-4,7-8,18,30H,5-6,9-10H2,1-2H3,(H,26,31)(H,24,25,27)/t18-/m1/s1
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n/an/a 1.32E+4n/an/an/an/an/an/a



Array BioPharma Inc

Curated by ChEMBL


Assay Description
Inhibition of ERK2 in human HepG2 cells assessed as P90RSK phosphorylation at Ser380 after 1.5 hrs by fluorescence assay


Bioorg Med Chem Lett 24: 2635-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.068
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%