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PubMed code 18606543

Compile data set for download or QSAR
Found 68 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
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263219
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H19N5OS/c1-13-16-8-9-24-19(16)6-5-18(13)26-21-14(11-23)12-25-22-17(21)10-15(29-22)4-7-20(28)27(2)3/h4-10,12,24H,1-3H3,(H,25,26)/b7-4+
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n/an/a 1.60n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263265
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CCN(CC)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C24H23N5OS/c1-4-29(5-2)22(30)9-6-17-12-19-23(16(13-25)14-27-24(19)31-17)28-20-7-8-21-18(15(20)3)10-11-26-21/h6-12,14,26H,4-5H2,1-3H3,(H,27,28)/b9-6+
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n/an/a 2n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50262606
PNG
(3-methyl-4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-...)
Show SMILES Cc1c(\C=C\C(=O)N2CCCC2)sc2ncc(C#N)c(Nc3ccc4[nH]ccc4c3C)c12
Show InChI InChI=1S/C25H23N5OS/c1-15-18-9-10-27-20(18)6-5-19(15)29-24-17(13-26)14-28-25-23(24)16(2)21(32-25)7-8-22(31)30-11-3-4-12-30/h5-10,14,27H,3-4,11-12H2,1-2H3,(H,28,29)/b8-7+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263218
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(N)=O)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C20H15N5OS/c1-11-14-6-7-23-17(14)4-3-16(11)25-19-12(9-21)10-24-20-15(19)8-13(27-20)2-5-18(22)26/h2-8,10,23H,1H3,(H2,22,26)(H,24,25)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263266
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CCNC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H19N5OS/c1-3-24-20(28)7-4-15-10-17-21(14(11-23)12-26-22(17)29-15)27-18-5-6-19-16(13(18)2)8-9-25-19/h4-10,12,25H,3H2,1-2H3,(H,24,28)(H,26,27)/b7-4+
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n/an/a 15n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50262605
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(pyrrolidin-1...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\CN4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H23N5S/c1-16-19-8-9-26-22(19)7-6-21(16)28-23-17(14-25)15-27-24-20(23)13-18(30-24)5-4-12-29-10-2-3-11-29/h4-9,13,15,26H,2-3,10-12H2,1H3,(H,27,28)/b5-4+
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n/an/a 22n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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n/an/a 25n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of FYN


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
SRC


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of HCK


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lyn


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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n/an/a 28n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of LYN


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263133
PNG
(2-(3-(3-hydroxypyrrolidin-1-yl)-3-oxoprop-1-enyl)-...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCC(O)C4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5O2S/c1-14-18-6-8-26-21(18)4-3-20(14)28-23-15(11-25)12-27-24-19(23)10-17(32-24)2-5-22(31)29-9-7-16(30)13-29/h2-6,8,10,12,16,26,30H,7,9,13H2,1H3,(H,27,28)/b5-2+
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n/an/a 41n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263217
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(4-methylpipe...)
Show SMILES CN1CCN(CC1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C25H24N6OS/c1-16-19-7-8-27-22(19)5-4-21(16)29-24-17(14-26)15-28-25-20(24)13-18(33-25)3-6-23(32)31-11-9-30(2)10-12-31/h3-8,13,15,27H,9-12H2,1-2H3,(H,28,29)/b6-3+
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n/an/a 43n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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n/an/a 46n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of LCK


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263175
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(piperi...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H23N5OS/c1-16-19-9-10-27-22(19)7-6-21(16)29-24-17(14-26)15-28-25-20(24)13-18(32-25)5-8-23(31)30-11-3-2-4-12-30/h5-10,13,15,27H,2-4,11-12H2,1H3,(H,28,29)/b8-5+
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n/an/a 48n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263268
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES COCCNC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C23H21N5O2S/c1-14-17-7-8-25-20(17)5-4-19(14)28-22-15(12-24)13-27-23-18(22)11-16(31-23)3-6-21(29)26-9-10-30-2/h3-8,11,13,25H,9-10H2,1-2H3,(H,26,29)(H,27,28)/b6-3+
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n/an/a 48n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263176
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-morpholino-3-...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCOCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5O2S/c1-15-18-6-7-26-21(18)4-3-20(15)28-23-16(13-25)14-27-24-19(23)12-17(32-24)2-5-22(30)29-8-10-31-11-9-29/h2-7,12,14,26H,8-11H2,1H3,(H,27,28)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50262604
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(pyrrolidine-...)
Show SMILES Cc1c(Nc2c(cnc3sc(cc23)-c2cccc(c2)C(=O)N2CCCC2)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H23N5OS/c1-17-21-9-10-30-24(21)8-7-23(17)32-26-20(15-29)16-31-27-22(26)14-25(35-27)18-5-4-6-19(13-18)28(34)33-11-2-3-12-33/h4-10,13-14,16,30H,2-3,11-12H2,1H3,(H,31,32)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263218
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(N)=O)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C20H15N5OS/c1-11-14-6-7-23-17(14)4-3-16(11)25-19-12(9-21)10-24-20-15(19)8-13(27-20)2-5-18(22)26/h2-8,10,23H,1H3,(H2,22,26)(H,24,25)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263217
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(4-methylpipe...)
Show SMILES CN1CCN(CC1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C25H24N6OS/c1-16-19-7-8-27-22(19)5-4-21(16)29-24-17(14-26)15-28-25-20(24)13-18(33-25)3-6-23(32)31-11-9-30(2)10-12-31/h3-8,13,15,27H,9-12H2,1-2H3,(H,28,29)/b6-3+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263216
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pipera...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCNCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H22N6OS/c1-15-18-6-7-27-21(18)4-3-20(15)29-23-16(13-25)14-28-24-19(23)12-17(32-24)2-5-22(31)30-10-8-26-9-11-30/h2-7,12,14,26-27H,8-11H2,1H3,(H,28,29)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263301
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)NC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H20N6OS/c1-13-16-8-9-24-19(16)6-5-18(13)26-21-14(11-23)12-25-22-17(21)10-15(30-22)4-7-20(29)27-28(2)3/h4-10,12,24H,1-3H3,(H,25,26)(H,27,29)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50262605
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(pyrrolidin-1...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\CN4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H23N5S/c1-16-19-8-9-26-22(19)7-6-21(16)28-23-17(14-25)15-27-24-20(23)13-18(30-24)5-4-12-29-10-2-3-11-29/h4-9,13,15,26H,2-3,10-12H2,1H3,(H,27,28)/b5-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263267
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)Nc4ccccc4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C26H19N5OS/c1-16-20-11-12-28-23(20)9-8-22(16)31-25-17(14-27)15-29-26-21(25)13-19(33-26)7-10-24(32)30-18-5-3-2-4-6-18/h2-13,15,28H,1H3,(H,29,31)(H,30,32)/b10-7+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50262607
PNG
(4-(1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrolidin-1-yl...)
Show SMILES O=C(\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3)c(cnc2s1)C#N)N1CCCC1
Show InChI InChI=1S/C23H19N5OS/c24-13-16-14-26-23-19(12-18(30-23)4-6-21(29)28-9-1-2-10-28)22(16)27-17-3-5-20-15(11-17)7-8-25-20/h3-8,11-12,14,25H,1-2,9-10H2,(H,26,27)/b6-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263300
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)CCN(C)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C25H26N6OS/c1-16-19-9-10-27-22(19)7-6-21(16)29-24-17(14-26)15-28-25-20(24)13-18(33-25)5-8-23(32)31(4)12-11-30(2)3/h5-10,13,15,27H,11-12H2,1-4H3,(H,28,29)/b8-5+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263174
PNG
((S)-2-(3-(3-(dimethylamino)pyrrolidin-1-yl)-3-oxop...)
Show SMILES CN(C)[C@H]1CCN(C1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N |r|
Show InChI InChI=1S/C26H26N6OS/c1-16-20-8-10-28-23(20)6-5-22(16)30-25-17(13-27)14-29-26-21(25)12-19(34-26)4-7-24(33)32-11-9-18(15-32)31(2)3/h4-8,10,12,14,18,28H,9,11,15H2,1-3H3,(H,29,30)/b7-4+/t18-/m0/s1
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263173
PNG
((R)-2-(3-(3-(dimethylamino)pyrrolidin-1-yl)-3-oxop...)
Show SMILES CN(C)[C@@H]1CCN(C1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N |r|
Show InChI InChI=1S/C26H26N6OS/c1-16-20-8-10-28-23(20)6-5-22(16)30-25-17(13-27)14-29-26-21(25)12-19(34-26)4-7-24(33)32-11-9-18(15-32)31(2)3/h4-8,10,12,14,18,28H,9,11,15H2,1-3H3,(H,29,30)/b7-4+/t18-/m1/s1
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50262604
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-(pyrrolidine-...)
Show SMILES Cc1c(Nc2c(cnc3sc(cc23)-c2cccc(c2)C(=O)N2CCCC2)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H23N5OS/c1-17-21-9-10-30-24(21)8-7-23(17)32-26-20(15-29)16-31-27-22(26)14-25(35-27)18-5-4-6-19(13-18)28(34)33-11-2-3-12-33/h4-10,13-14,16,30H,2-3,11-12H2,1H3,(H,31,32)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263216
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pipera...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCNCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H22N6OS/c1-15-18-6-7-27-21(18)4-3-20(15)29-23-16(13-25)14-28-24-19(23)12-17(32-24)2-5-22(31)30-10-8-26-9-11-30/h2-7,12,14,26-27H,8-11H2,1H3,(H,28,29)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263265
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CCN(CC)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C24H23N5OS/c1-4-29(5-2)22(30)9-6-17-12-19-23(16(13-25)14-27-24(19)31-17)28-20-7-8-21-18(15(20)3)10-11-26-21/h6-12,14,26H,4-5H2,1-3H3,(H,27,28)/b9-6+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263303
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(CCC(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H23N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h5-6,8-9,12,14,26H,2-4,7,10-11H2,1H3,(H,27,28)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263302
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)NN4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H22N6OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(32-24)4-7-22(31)29-30-10-2-3-11-30/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)(H,29,31)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of SRC


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263174
PNG
((S)-2-(3-(3-(dimethylamino)pyrrolidin-1-yl)-3-oxop...)
Show SMILES CN(C)[C@H]1CCN(C1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N |r|
Show InChI InChI=1S/C26H26N6OS/c1-16-20-8-10-28-23(20)6-5-22(16)30-25-17(13-27)14-29-26-21(25)12-19(34-26)4-7-24(33)32-11-9-18(15-32)31(2)3/h4-8,10,12,14,18,28H,9,11,15H2,1-3H3,(H,29,30)/b7-4+/t18-/m0/s1
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50263302
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)NN4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H22N6OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(32-24)4-7-22(31)29-30-10-2-3-11-30/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)(H,29,31)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50262606
PNG
(3-methyl-4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-...)
Show SMILES Cc1c(\C=C\C(=O)N2CCCC2)sc2ncc(C#N)c(Nc3ccc4[nH]ccc4c3C)c12
Show InChI InChI=1S/C25H23N5OS/c1-15-18-9-10-27-20(18)6-5-19(15)29-24-17(13-26)14-28-25-23(24)16(2)21(32-25)7-8-22(31)30-11-3-4-12-30/h5-10,14,27H,3-4,11-12H2,1-2H3,(H,28,29)/b8-7+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263301
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)NC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H20N6OS/c1-13-16-8-9-24-19(16)6-5-18(13)26-21-14(11-23)12-25-22-17(21)10-15(30-22)4-7-20(29)27-28(2)3/h4-10,12,24H,1-3H3,(H,25,26)(H,27,29)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263173
PNG
((R)-2-(3-(3-(dimethylamino)pyrrolidin-1-yl)-3-oxop...)
Show SMILES CN(C)[C@@H]1CCN(C1)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N |r|
Show InChI InChI=1S/C26H26N6OS/c1-16-20-8-10-28-23(20)6-5-22(16)30-25-17(13-27)14-29-26-21(25)12-19(34-26)4-7-24(33)32-11-9-18(15-32)31(2)3/h4-8,10,12,14,18,28H,9,11,15H2,1-3H3,(H,29,30)/b7-4+/t18-/m1/s1
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263133
PNG
(2-(3-(3-hydroxypyrrolidin-1-yl)-3-oxoprop-1-enyl)-...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCC(O)C4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5O2S/c1-14-18-6-8-26-21(18)4-3-20(14)28-23-15(11-25)12-27-24-19(23)10-17(32-24)2-5-22(31)29-9-7-16(30)13-29/h2-6,8,10,12,16,26,30H,7,9,13H2,1H3,(H,27,28)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263175
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(piperi...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H23N5OS/c1-16-19-9-10-27-22(19)7-6-21(16)29-24-17(14-26)15-28-25-20(24)13-18(32-25)5-8-23(31)30-11-3-2-4-12-30/h5-10,13,15,27H,2-4,11-12H2,1H3,(H,28,29)/b8-5+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263266
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CCNC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H19N5OS/c1-3-24-20(28)7-4-15-10-17-21(14(11-23)12-26-22(17)29-15)27-18-5-6-19-16(13(18)2)8-9-25-19/h4-10,12,25H,3H2,1-2H3,(H,24,28)(H,26,27)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263267
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)Nc4ccccc4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C26H19N5OS/c1-16-20-11-12-28-23(20)9-8-22(16)31-25-17(14-27)15-29-26-21(25)13-19(33-26)7-10-24(32)30-18-5-3-2-4-6-18/h2-13,15,28H,1H3,(H,29,31)(H,30,32)/b10-7+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263300
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)CCN(C)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C25H26N6OS/c1-16-19-9-10-27-22(19)7-6-21(16)29-24-17(14-26)15-28-25-20(24)13-18(33-25)5-8-23(32)31(4)12-11-30(2)3/h5-10,13,15,27H,11-12H2,1-4H3,(H,28,29)/b8-5+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263268
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES COCCNC(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C23H21N5O2S/c1-14-17-7-8-25-20(17)5-4-19(14)28-22-15(12-24)13-27-23-18(22)11-16(31-23)3-6-21(29)26-9-10-30-2/h3-8,11,13,25H,9-10H2,1-2H3,(H,26,29)(H,27,28)/b6-3+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263303
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(CCC(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H23N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h5-6,8-9,12,14,26H,2-4,7,10-11H2,1H3,(H,27,28)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263219
PNG
(3-(5-cyano-4-(4-methyl-1H-indol-5-ylamino)thieno[2...)
Show SMILES CN(C)C(=O)\C=C\c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
Show InChI InChI=1S/C22H19N5OS/c1-13-16-8-9-24-19(16)6-5-18(13)26-21-14(11-23)12-25-22-17(21)10-15(29-22)4-7-20(28)27(2)3/h4-10,12,24H,1-3H3,(H,25,26)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C, epsilon


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCepsilon


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50263176
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-morpholino-3-...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCOCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5O2S/c1-15-18-6-7-26-21(18)4-3-20(15)28-23-16(13-25)14-27-24-19(23)12-17(32-24)2-5-22(30)29-8-10-31-11-9-29/h2-7,12,14,26H,8-11H2,1H3,(H,27,28)/b5-2+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Tyrosine-protein kinase ITK/TSK


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of ITK


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of MK2


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of ERK2


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of P38alpha


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of IKK-beta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of ROCK1


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCalpha


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of IKKalpha


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of CDK1/cyclinB


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Casein kinase I


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of CK1gamma1


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of CHK1


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha 1


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of RSK1


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of MET


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Aurora B


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C, eta


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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n/an/a 5.10E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCeta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
Protein kinase C (PKC)


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCzeta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
PKC alpha and beta-2


(Homo sapiens (Human))
BDBM50263132
PNG
(4-(4-methyl-1H-indol-5-ylamino)-2-(3-oxo-3-(pyrrol...)
Show SMILES Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H21N5OS/c1-15-18-8-9-26-21(18)6-5-20(15)28-23-16(13-25)14-27-24-19(23)12-17(31-24)4-7-22(30)29-10-2-3-11-29/h4-9,12,14,26H,2-3,10-11H2,1H3,(H,27,28)/b7-4+
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCbeta


Bioorg Med Chem Lett 18: 4420-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.040
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%