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37 similar compounds to monomer 50119307

Compile data set for download or QSAR
Wt: 262.3
BDBM50119279
Wt: 248.3
BDBM50119283
Wt: 262.3
BDBM50119298
Wt: 248.3
BDBM50297142
Wt: 368.4
BDBM50297143
Wt: 302.3
BDBM50297144
Wt: 305.3
BDBM50297136
Wt: 319.4
BDBM50297137
Wt: 367.4
BDBM50297138
Wt: 331.4
BDBM50297139
Wt: 347.4
BDBM50297140
Wt: 381.4
BDBM50297141
Wt: 306.3
BDBM50297145
Wt: 304.4
BDBM50297146
Wt: 320.3
BDBM50297147
Displayed 1 to 15 (of 37 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 44 hits for monomerid = 50119279,50119283,50119298,50297142,50297143,50297144,50297136,50297137,50297138,50297139,50297140,50297141,50297145,50297146,50297147   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4882-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.017
BindingDB Entry DOI: 10.7270/Q2J38SM7
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297136
PNG
((R)-7-Ethylaminomethyl-3-methoxy-5,6,7,8-tetrahydr...)
Show SMILES CCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C15H19N3O2S/c1-3-16-7-9-8-17-13-11-6-10(20-2)4-5-12(11)21-14(13)15(19)18-9/h4-6,9,16-17H,3,7-8H2,1-2H3,(H,18,19)/t9-/m1/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 700n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4882-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.017
BindingDB Entry DOI: 10.7270/Q2J38SM7
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297136
PNG
((R)-7-Ethylaminomethyl-3-methoxy-5,6,7,8-tetrahydr...)
Show SMILES CCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C15H19N3O2S/c1-3-16-7-9-8-17-13-11-6-10(20-2)4-5-12(11)21-14(13)15(19)18-9/h4-6,9,16-17H,3,7-8H2,1-2H3,(H,18,19)/t9-/m1/s1
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n/an/a 2.16E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297137
PNG
((R)-3-Methoxy-7-propylaminomethyl-5,6,7,8-tetrahyd...)
Show SMILES CCCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C16H21N3O2S/c1-3-6-17-8-10-9-18-14-12-7-11(21-2)4-5-13(12)22-15(14)16(20)19-10/h4-5,7,10,17-18H,3,6,8-9H2,1-2H3,(H,19,20)/t10-/m1/s1
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n/an/a 450n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297137
PNG
((R)-3-Methoxy-7-propylaminomethyl-5,6,7,8-tetrahyd...)
Show SMILES CCCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C16H21N3O2S/c1-3-6-17-8-10-9-18-14-12-7-11(21-2)4-5-13(12)22-15(14)16(20)19-10/h4-5,7,10,17-18H,3,6,8-9H2,1-2H3,(H,19,20)/t10-/m1/s1
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n/an/a 2.60E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297137
PNG
((R)-3-Methoxy-7-propylaminomethyl-5,6,7,8-tetrahyd...)
Show SMILES CCCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C16H21N3O2S/c1-3-6-17-8-10-9-18-14-12-7-11(21-2)4-5-13(12)22-15(14)16(20)19-10/h4-5,7,10,17-18H,3,6,8-9H2,1-2H3,(H,19,20)/t10-/m1/s1
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n/an/a 1.49E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297138
PNG
((R)-7-(Benzylamino-methyl)-3-methoxy-5,6,7,8-tetra...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CNCc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C20H21N3O2S/c1-25-15-7-8-17-16(9-15)18-19(26-17)20(24)23-14(12-22-18)11-21-10-13-5-3-2-4-6-13/h2-9,14,21-22H,10-12H2,1H3,(H,23,24)/t14-/m1/s1
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n/an/a 570n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297138
PNG
((R)-7-(Benzylamino-methyl)-3-methoxy-5,6,7,8-tetra...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CNCc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C20H21N3O2S/c1-25-15-7-8-17-16(9-15)18-19(26-17)20(24)23-14(12-22-18)11-21-10-13-5-3-2-4-6-13/h2-9,14,21-22H,10-12H2,1H3,(H,23,24)/t14-/m1/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297138
PNG
((R)-7-(Benzylamino-methyl)-3-methoxy-5,6,7,8-tetra...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CNCc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C20H21N3O2S/c1-25-15-7-8-17-16(9-15)18-19(26-17)20(24)23-14(12-22-18)11-21-10-13-5-3-2-4-6-13/h2-9,14,21-22H,10-12H2,1H3,(H,23,24)/t14-/m1/s1
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n/an/a 2.10E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297139
PNG
((S)-3-Methoxy-7-pyrrolidin-1-ylmethyl-5,6,7,8-tetr...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CN4CCCC4)NC3=O)c2c1
Show InChI InChI=1S/C17H21N3O2S/c1-22-12-4-5-14-13(8-12)15-16(23-14)17(21)19-11(9-18-15)10-20-6-2-3-7-20/h4-5,8,11,18H,2-3,6-7,9-10H2,1H3,(H,19,21)/t11-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297140
PNG
((S)-3-Methoxy-7-morpholin-4-ylmethyl-5,6,7,8-tetra...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CN4CCOCC4)NC3=O)c2c1
Show InChI InChI=1S/C17H21N3O3S/c1-22-12-2-3-14-13(8-12)15-16(24-14)17(21)19-11(9-18-15)10-20-4-6-23-7-5-20/h2-3,8,11,18H,4-7,9-10H2,1H3,(H,19,21)/t11-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297141
PNG
((S)-7-[(Benzyl-methyl-amino)-methyl]-3-methoxy-5,6...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CN(C)Cc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C21H23N3O2S/c1-24(12-14-6-4-3-5-7-14)13-15-11-22-19-17-10-16(26-2)8-9-18(17)27-20(19)21(25)23-15/h3-10,15,22H,11-13H2,1-2H3,(H,23,25)/t15-/m0/s1
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n/an/a 1.91E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297141
PNG
((S)-7-[(Benzyl-methyl-amino)-methyl]-3-methoxy-5,6...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CN(C)Cc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C21H23N3O2S/c1-24(12-14-6-4-3-5-7-14)13-15-11-22-19-17-10-16(26-2)8-9-18(17)27-20(19)21(25)23-15/h3-10,15,22H,11-13H2,1-2H3,(H,23,25)/t15-/m0/s1
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n/an/a 3.17E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297141
PNG
((S)-7-[(Benzyl-methyl-amino)-methyl]-3-methoxy-5,6...)
Show SMILES COc1ccc2sc3c(NC[C@@H](CN(C)Cc4ccccc4)NC3=O)c2c1
Show InChI InChI=1S/C21H23N3O2S/c1-24(12-14-6-4-3-5-7-14)13-15-11-22-19-17-10-16(26-2)8-9-18(17)27-20(19)21(25)23-15/h3-10,15,22H,11-13H2,1-2H3,(H,23,25)/t15-/m0/s1
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n/an/a 2.40E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297142
PNG
((R)-3-Hydroxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(O)cc23)C(=O)N1
Show InChI InChI=1S/C12H12N2O2S/c1-6-5-13-10-8-4-7(15)2-3-9(8)17-11(10)12(16)14-6/h2-4,6,13,15H,5H2,1H3,(H,14,16)/t6-/m1/s1
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n/an/a 190n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297142
PNG
((R)-3-Hydroxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(O)cc23)C(=O)N1
Show InChI InChI=1S/C12H12N2O2S/c1-6-5-13-10-8-4-7(15)2-3-9(8)17-11(10)12(16)14-6/h2-4,6,13,15H,5H2,1H3,(H,14,16)/t6-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297142
PNG
((R)-3-Hydroxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(O)cc23)C(=O)N1
Show InChI InChI=1S/C12H12N2O2S/c1-6-5-13-10-8-4-7(15)2-3-9(8)17-11(10)12(16)14-6/h2-4,6,13,15H,5H2,1H3,(H,14,16)/t6-/m1/s1
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n/an/a 3.50E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297143
PNG
((R)-3-(3-Methoxy-benzyloxy)-7-methyl-5,6,7,8-tetra...)
Show SMILES COc1cccc(COc2ccc3sc4c(NC[C@@H](C)NC4=O)c3c2)c1
Show InChI InChI=1S/C20H20N2O3S/c1-12-10-21-18-16-9-15(6-7-17(16)26-19(18)20(23)22-12)25-11-13-4-3-5-14(8-13)24-2/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)/t12-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297143
PNG
((R)-3-(3-Methoxy-benzyloxy)-7-methyl-5,6,7,8-tetra...)
Show SMILES COc1cccc(COc2ccc3sc4c(NC[C@@H](C)NC4=O)c3c2)c1
Show InChI InChI=1S/C20H20N2O3S/c1-12-10-21-18-16-9-15(6-7-17(16)26-19(18)20(23)22-12)25-11-13-4-3-5-14(8-13)24-2/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)/t12-/m1/s1
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n/an/a 64n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297143
PNG
((R)-3-(3-Methoxy-benzyloxy)-7-methyl-5,6,7,8-tetra...)
Show SMILES COc1cccc(COc2ccc3sc4c(NC[C@@H](C)NC4=O)c3c2)c1
Show InChI InChI=1S/C20H20N2O3S/c1-12-10-21-18-16-9-15(6-7-17(16)26-19(18)20(23)22-12)25-11-13-4-3-5-14(8-13)24-2/h3-9,12,21H,10-11H2,1-2H3,(H,22,23)/t12-/m1/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297144
PNG
((R)-3-Cyclopropylmethoxy-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(OCC4CC4)cc23)C(=O)N1
Show InChI InChI=1S/C16H18N2O2S/c1-9-7-17-14-12-6-11(20-8-10-2-3-10)4-5-13(12)21-15(14)16(19)18-9/h4-6,9-10,17H,2-3,7-8H2,1H3,(H,18,19)/t9-/m1/s1
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n/an/a 1.32E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297144
PNG
((R)-3-Cyclopropylmethoxy-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(OCC4CC4)cc23)C(=O)N1
Show InChI InChI=1S/C16H18N2O2S/c1-9-7-17-14-12-6-11(20-8-10-2-3-10)4-5-13(12)21-15(14)16(19)18-9/h4-6,9-10,17H,2-3,7-8H2,1H3,(H,18,19)/t9-/m1/s1
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n/an/a 52n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297144
PNG
((R)-3-Cyclopropylmethoxy-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES C[C@@H]1CNc2c(sc3ccc(OCC4CC4)cc23)C(=O)N1
Show InChI InChI=1S/C16H18N2O2S/c1-9-7-17-14-12-6-11(20-8-10-2-3-10)4-5-13(12)21-15(14)16(19)18-9/h4-6,9-10,17H,2-3,7-8H2,1H3,(H,18,19)/t9-/m1/s1
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n/an/a 2.70E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297145
PNG
((R)-3-(2-Methoxy-ethoxy)-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES COCCOc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H18N2O3S/c1-9-8-16-13-11-7-10(20-6-5-19-2)3-4-12(11)21-14(13)15(18)17-9/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,17,18)/t9-/m1/s1
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n/an/a 270n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297145
PNG
((R)-3-(2-Methoxy-ethoxy)-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES COCCOc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H18N2O3S/c1-9-8-16-13-11-7-10(20-6-5-19-2)3-4-12(11)21-14(13)15(18)17-9/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,17,18)/t9-/m1/s1
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n/an/a 81n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297145
PNG
((R)-3-(2-Methoxy-ethoxy)-7-methyl-5,6,7,8-tetrahyd...)
Show SMILES COCCOc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H18N2O3S/c1-9-8-16-13-11-7-10(20-6-5-19-2)3-4-12(11)21-14(13)15(18)17-9/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,17,18)/t9-/m1/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297146
PNG
((R)-3-Isobutoxy-7-methyl-5,6,7,8-tetrahydro-10-thi...)
Show SMILES CC(C)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C16H20N2O2S/c1-9(2)8-20-11-4-5-13-12(6-11)14-15(21-13)16(19)18-10(3)7-17-14/h4-6,9-10,17H,7-8H2,1-3H3,(H,18,19)/t10-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297146
PNG
((R)-3-Isobutoxy-7-methyl-5,6,7,8-tetrahydro-10-thi...)
Show SMILES CC(C)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C16H20N2O2S/c1-9(2)8-20-11-4-5-13-12(6-11)14-15(21-13)16(19)18-10(3)7-17-14/h4-6,9-10,17H,7-8H2,1-3H3,(H,18,19)/t10-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297146
PNG
((R)-3-Isobutoxy-7-methyl-5,6,7,8-tetrahydro-10-thi...)
Show SMILES CC(C)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C16H20N2O2S/c1-9(2)8-20-11-4-5-13-12(6-11)14-15(21-13)16(19)18-10(3)7-17-14/h4-6,9-10,17H,7-8H2,1-3H3,(H,18,19)/t10-/m1/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297147
PNG
(((R)-7-Methyl-9-oxo-6,7,8,9-tetrahydro-5H-10-thia-...)
Show SMILES COC(=O)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H16N2O4S/c1-8-6-16-13-10-5-9(21-7-12(18)20-2)3-4-11(10)22-14(13)15(19)17-8/h3-5,8,16H,6-7H2,1-2H3,(H,17,19)/t8-/m1/s1
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n/an/a 3.44E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50297147
PNG
(((R)-7-Methyl-9-oxo-6,7,8,9-tetrahydro-5H-10-thia-...)
Show SMILES COC(=O)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H16N2O4S/c1-8-6-16-13-10-5-9(21-7-12(18)20-2)3-4-11(10)22-14(13)15(19)17-8/h3-5,8,16H,6-7H2,1-2H3,(H,17,19)/t8-/m1/s1
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n/an/a 3.09E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297147
PNG
(((R)-7-Methyl-9-oxo-6,7,8,9-tetrahydro-5H-10-thia-...)
Show SMILES COC(=O)COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C15H16N2O4S/c1-8-6-16-13-10-5-9(21-7-12(18)20-2)3-4-11(10)22-14(13)15(19)17-8/h3-5,8,16H,6-7H2,1-2H3,(H,17,19)/t8-/m1/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119283
PNG
(3-Methoxy-5,6,7,8-tetrahydro-10-thia-5,8-diaza-ben...)
Show SMILES COc1ccc2sc3c(NCCNC3=O)c2c1
Show InChI InChI=1S/C12H12N2O2S/c1-16-7-2-3-9-8(6-7)10-11(17-9)12(15)14-5-4-13-10/h2-3,6,13H,4-5H2,1H3,(H,14,15)
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n/an/a 180n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50119283
PNG
(3-Methoxy-5,6,7,8-tetrahydro-10-thia-5,8-diaza-ben...)
Show SMILES COc1ccc2sc3c(NCCNC3=O)c2c1
Show InChI InChI=1S/C12H12N2O2S/c1-16-7-2-3-9-8(6-7)10-11(17-9)12(15)14-5-4-13-10/h2-3,6,13H,4-5H2,1H3,(H,14,15)
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n/an/a 160n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119283
PNG
(3-Methoxy-5,6,7,8-tetrahydro-10-thia-5,8-diaza-ben...)
Show SMILES COc1ccc2sc3c(NCCNC3=O)c2c1
Show InChI InChI=1S/C12H12N2O2S/c1-16-7-2-3-9-8(6-7)10-11(17-9)12(15)14-5-4-13-10/h2-3,6,13H,4-5H2,1H3,(H,14,15)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 700n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119279
PNG
((S)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m0/s1
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n/an/a 300n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50119279
PNG
((S)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m0/s1
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n/an/a 260n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50119279
PNG
((S)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m0/s1
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n/an/a 3.80E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2 in human U937 cells assessed as blockade of LPS-stimulated TNFalpha production


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50297136
PNG
((R)-7-Ethylaminomethyl-3-methoxy-5,6,7,8-tetrahydr...)
Show SMILES CCNC[C@@H]1CNc2c(sc3ccc(OC)cc23)C(=O)N1
Show InChI InChI=1S/C15H19N3O2S/c1-3-16-7-9-8-17-13-11-6-10(20-2)4-5-12(11)21-14(13)15(19)18-9/h4-6,9,16-17H,3,7-8H2,1-2H3,(H,18,19)/t9-/m1/s1
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n/an/a 570n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 19: 4878-81 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.015
BindingDB Entry DOI: 10.7270/Q28K795K
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50119298
PNG
((R)-3-Methoxy-7-methyl-5,6,7,8-tetrahydro-10-thia-...)
Show SMILES COc1ccc2sc3c(NC[C@@H](C)NC3=O)c2c1
Show InChI InChI=1S/C13H14N2O2S/c1-7-6-14-11-9-5-8(17-2)3-4-10(9)18-12(11)13(16)15-7/h3-5,7,14H,6H2,1-2H3,(H,15,16)/t7-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 19: 4882-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.017
BindingDB Entry DOI: 10.7270/Q2J38SM7
More data for this
Ligand-Target Pair