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PubMed code 27994729

Compile data set for download or QSAR
Found 18 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))
BDBM50203146
PNG
(CHEMBL3902533)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@@H](O)Cc(n3)c12)c1cccc(Cl)c1 |r|
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n/an/a 0.996n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203125
PNG
(CHEMBL3917936)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H]([C@@H](CO)OCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 3.40n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203124
PNG
(CHEMBL3916619)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@H](O)Cc(n3)c12)c1ccccc1 |r|
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n/an/a 3.5n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203118
PNG
(CHEMBL3962242)
Show SMILES [H][C@]1(OCCCc2nc(NC(=O)N[C@@H]1c1ccccc1)cc1cnn(CC)c21)[C@H](C)O |r|
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n/an/a 4.10n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203114
PNG
(CHEMBL3936937)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COCCNc(n3)c12)c1ccccc1 |r|
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n/an/a 5n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203116
PNG
(CHEMBL3925782)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@@H](O)Cc(n3)c12)c1ccc(Cl)c(F)c1 |r|
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n/an/a 5.10n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203117
PNG
(CHEMBL3934673)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@@H](O)Cc(n3)c12)c1ccc(OC)c(F)c1 |r|
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n/an/a 6.30n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203152
PNG
(CHEMBL3964039)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 8.80n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203150
PNG
(CHEMBL3980079)
Show SMILES Cn1ncc2cc3NC(=O)N[C@H](COCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 10n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203115
PNG
(CHEMBL3986381)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@@H](O)Cc(n3)c12)c1ccccc1 |r|
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n/an/a 14n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203151
PNG
(CHEMBL3962160)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](COC[C@@H](O)Cc(n3)c12)c1cccc(F)c1 |r|
PDB
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n/an/a 14n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203149
PNG
(CHEMBL3954524)
Show SMILES CCn1ncc2cc3NC(=O)N[C@@H](c4ccccc4)C(C)(C)OCCCc(n3)c12 |r|
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n/an/a 16n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203148
PNG
(CHEMBL3909003)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H]([C@@H](O)OCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 24n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203120
PNG
(CHEMBL3927938)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H]([C@H](O)OCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 118n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203119
PNG
(CHEMBL3899948)
Show SMILES CCn1ncc2cc3NC(=O)N[C@@H](c4ccccc4)C(C)(C)OC\C=C/c(n3)c12 |r,c:25|
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n/an/a 634n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203147
PNG
(CHEMBL3893222)
Show SMILES [H][C@]1(OCCCc2nc(NC(=O)N[C@@H]1c1ccccc1)cc1cnn(CC)c21)[C@@H](C)O |r|
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n/an/a 687n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203123
PNG
(CHEMBL3926893)
Show SMILES CCn1ncc2cc3NC(=O)N[C@H](c4ccccc4)C(C)(C)OCCCc(n3)c12 |r|
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n/an/a 734n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50203121
PNG
(CHEMBL3945821)
Show SMILES CCn1ncc2cc3NC(=O)N[C@@H]([C@H](CO)OCCCc(n3)c12)c1ccccc1 |r|
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n/an/a 757n/an/an/an/an/an/a



Dart Neuroscience LLC

Curated by ChEMBL


Assay Description
Inhibition of human activated ERK2 assessed as reduction in phosphorylation activity preincubated for 15 mins followed by addition of IMAP peptide as...


ACS Med Chem Lett 7: 1020-1021 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00434
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%