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PubMed code 19884013

Compile data set for download or QSAR
Found 98 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))
BDBM35129
PNG
(5-vinyl-3-pyridinecarbonitrile, 14b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-17-21-7-10-28-23(21)6-5-22(17)29-24-18(15-27-16-19(24)14-25)4-2-3-11-30-12-8-20(26)9-13-30/h2,4-7,10,15-16,20,28H,3,8-9,11-13,26H2,1H3,(H,27,29)/b4-2+
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n/an/a 0.880n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35141
PNG
(5-vinyl-3-pyridinecarbonitrile, 23)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H26N6/c1-16-20-7-9-27-22(20)6-5-21(16)28-23-17(13-26-14-18(23)12-24)4-2-3-10-29-11-8-19(25)15-29/h2,4-7,9,13-14,19,27H,3,8,10-11,15,25H2,1H3,(H,26,28)/b4-2+/t19-/m0/s1
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n/an/a 1.30n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35137
PNG
(5-vinyl-3-pyridinecarbonitrile, 19)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H28N6/c1-17-21-9-10-28-23(21)8-7-22(17)29-24-18(14-27-15-19(24)13-25)5-2-3-11-30-12-4-6-20(26)16-30/h2,5,7-10,14-15,20,28H,3-4,6,11-12,16,26H2,1H3,(H,27,29)/b5-2+/t20-/m1/s1
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n/an/a 1.80n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35123
PNG
(5-vinyl-3-pyridinecarbonitrile, 12b)
Show SMILES CN1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C24H28N6/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-4-10-30-13-11-29(2)12-14-30/h3,5-9,16-17,27H,4,10-14H2,1-2H3,(H,26,28)/b5-3+
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n/an/a 2.20n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35123
PNG
(5-vinyl-3-pyridinecarbonitrile, 12b)
Show SMILES CN1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C24H28N6/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-4-10-30-13-11-29(2)12-14-30/h3,5-9,16-17,27H,4,10-14H2,1-2H3,(H,26,28)/b5-3+
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n/an/a 2.5n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35127
PNG
(5-vinyl-3-pyridinecarbonitrile, 13c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-18-21-8-9-28-23(21)7-6-22(18)29-24-19(16-27-17-20(24)15-25)5-3-2-4-12-30-13-10-26-11-14-30/h3,5-9,16-17,26,28H,2,4,10-14H2,1H3,(H,27,29)/b5-3+
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n/an/a 2.80n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35155
PNG
(5-vinyl-3-pyridinecarbonitrile, 37)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C29H30N6/c1-22-26-12-13-32-28(26)11-10-27(22)33-29-23(20-31-21-24(29)19-30)7-5-6-14-34-15-17-35(18-16-34)25-8-3-2-4-9-25/h2-5,7-13,20-21,32H,6,14-18H2,1H3,(H,31,33)/b7-5+
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n/an/a 3.40n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35140
PNG
(5-vinyl-3-pyridinecarbonitrile, 22)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H26N6/c1-16-20-7-9-27-22(20)6-5-21(16)28-23-17(13-26-14-18(23)12-24)4-2-3-10-29-11-8-19(25)15-29/h2,4-7,9,13-14,19,27H,3,8,10-11,15,25H2,1H3,(H,26,28)/b4-2+/t19-/m1/s1
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n/an/a 3.5n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35128
PNG
(5-vinyl-3-pyridinecarbonitrile, 14a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H26N6/c1-16-20-6-9-27-22(20)5-4-21(16)28-23-17(14-26-15-18(23)13-24)3-2-10-29-11-7-19(25)8-12-29/h2-6,9,14-15,19,27H,7-8,10-12,25H2,1H3,(H,26,28)/b3-2+
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n/an/a 3.60n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35154
PNG
(5-vinyl-3-pyridinecarbonitrile, 36)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-18-21-8-10-28-23(21)7-6-22(18)29-24-19(16-27-17-20(24)15-25)5-2-3-12-30-13-4-9-26-11-14-30/h2,5-8,10,16-17,26,28H,3-4,9,11-14H2,1H3,(H,27,29)/b5-2+
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n/an/a 3.60n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35126
PNG
(5-vinyl-3-pyridinecarbonitrile, 13b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H26N6/c1-17-20-7-8-27-22(20)6-5-21(17)28-23-18(15-26-16-19(23)14-24)4-2-3-11-29-12-9-25-10-13-29/h2,4-8,15-16,25,27H,3,9-13H2,1H3,(H,26,28)/b4-2+
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n/an/a 4n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35135
PNG
(5-vinyl-3-pyridinecarbonitrile, 17)
Show SMILES CN(C)C1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6/c1-19-23-9-12-29-25(23)8-7-24(19)30-26-20(17-28-18-21(26)16-27)6-4-5-13-32-14-10-22(11-15-32)31(2)3/h4,6-9,12,17-18,22,29H,5,10-11,13-15H2,1-3H3,(H,28,30)/b6-4+
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n/an/a 4.90n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35130
PNG
(5-vinyl-3-pyridinecarbonitrile, 14c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6/c1-18-22-8-11-29-24(22)7-6-23(18)30-25-19(16-28-17-20(25)15-26)5-3-2-4-12-31-13-9-21(27)10-14-31/h3,5-8,11,16-17,21,29H,2,4,9-10,12-14,27H2,1H3,(H,28,30)/b5-3+
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n/an/a 5.20n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35165
PNG
(3-pyridinecarbonitrile, 48)
Show SMILES Cc1c(Nc2c(CCCCN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H30N6/c1-17-21-7-10-28-23(21)6-5-22(17)29-24-18(15-27-16-19(24)14-25)4-2-3-11-30-12-8-20(26)9-13-30/h5-7,10,15-16,20,28H,2-4,8-9,11-13,26H2,1H3,(H,27,29)
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Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35136
PNG
(5-vinyl-3-pyridinecarbonitrile, 18)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CN)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6/c1-18-22-7-10-29-24(22)6-5-23(18)30-25-20(16-28-17-21(25)15-27)4-2-3-11-31-12-8-19(14-26)9-13-31/h2,4-7,10,16-17,19,29H,3,8-9,11-14,26H2,1H3,(H,28,30)/b4-2+
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n/an/a 5.70n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35129
PNG
(5-vinyl-3-pyridinecarbonitrile, 14b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-17-21-7-10-28-23(21)6-5-22(17)29-24-18(15-27-16-19(24)14-25)4-2-3-11-30-12-8-20(26)9-13-30/h2,4-7,10,15-16,20,28H,3,8-9,11-13,26H2,1H3,(H,27,29)/b4-2+
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n/an/a 5.80n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35132
PNG
(5-vinyl-3-pyridinecarbonitrile, 15b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5O/c1-17-21-7-10-27-23(21)6-5-22(17)28-24-18(15-26-16-19(24)14-25)4-2-3-11-29-12-8-20(30)9-13-29/h2,4-7,10,15-16,20,27,30H,3,8-9,11-13H2,1H3,(H,26,28)/b4-2+
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PubMed
n/an/a 6n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35124
PNG
(5-vinyl-3-pyridinecarbonitrile, 12c)
Show SMILES CN1CCN(CCC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6/c1-19-22-9-10-28-24(22)8-7-23(19)29-25-20(17-27-18-21(25)16-26)6-4-3-5-11-31-14-12-30(2)13-15-31/h4,6-10,17-18,28H,3,5,11-15H2,1-2H3,(H,27,29)/b6-4+
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n/an/a 6.40n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35138
PNG
(5-vinyl-3-pyridinecarbonitrile, 20)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H28N6/c1-17-21-9-10-28-23(21)8-7-22(17)29-24-18(14-27-15-19(24)13-25)5-2-3-11-30-12-4-6-20(26)16-30/h2,5,7-10,14-15,20,28H,3-4,6,11-12,16,26H2,1H3,(H,27,29)/b5-2+/t20-/m0/s1
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n/an/a 6.80n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35151
PNG
(5-vinyl-3-pyridinecarbonitrile, 33)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H25N5O/c1-16-20-7-9-26-22(20)6-5-21(16)27-23-17(13-25-14-18(23)12-24)4-2-3-10-28-11-8-19(29)15-28/h2,4-7,9,13-14,19,26,29H,3,8,10-11,15H2,1H3,(H,25,27)/b4-2+/t19-/m1/s1
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n/an/a 7.40n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35128
PNG
(5-vinyl-3-pyridinecarbonitrile, 14a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H26N6/c1-16-20-6-9-27-22(20)5-4-21(16)28-23-17(14-26-15-18(23)13-24)3-2-10-29-11-7-19(25)8-12-29/h2-6,9,14-15,19,27H,7-8,10-12,25H2,1H3,(H,26,28)/b3-2+
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n/an/a 8n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35139
PNG
(5-vinyl-3-pyridinecarbonitrile, 21)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC(N)C3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H24N6/c1-15-19-7-8-26-21(19)6-5-20(15)27-22-16(11-25-12-17(22)10-23)4-2-3-9-28-13-18(24)14-28/h2,4-8,11-12,18,26H,3,9,13-14,24H2,1H3,(H,25,27)/b4-2+
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n/an/a 8.90n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35134
PNG
(5-vinyl-3-pyridinecarbonitrile, 16)
Show SMILES CNC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6/c1-18-22-8-11-29-24(22)7-6-23(18)30-25-19(16-28-17-20(25)15-26)5-3-4-12-31-13-9-21(27-2)10-14-31/h3,5-8,11,16-17,21,27,29H,4,9-10,12-14H2,1-2H3,(H,28,30)/b5-3+
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n/an/a 9.30n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35125
PNG
(5-vinyl-3-pyridinecarbonitrile, 13a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H24N6/c1-16-19-6-7-26-21(19)5-4-20(16)27-22-17(14-25-15-18(22)13-23)3-2-10-28-11-8-24-9-12-28/h2-7,14-15,24,26H,8-12H2,1H3,(H,25,27)/b3-2+
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n/an/a 10n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35133
PNG
(5-vinyl-3-pyridinecarbonitrile, 15c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-2-4-12-30-13-9-21(31)10-14-30/h3,5-8,11,16-17,21,28,31H,2,4,9-10,12-14H2,1H3,(H,27,29)/b5-3+
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n/an/a 11n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35160
PNG
(5-vinyl-3-pyridinecarbonitrile, 42)
Show SMILES CC(C)S(=O)(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6O2S/c1-19(2)35(33,34)32-14-12-31(13-15-32)11-5-4-6-21-17-28-18-22(16-27)26(21)30-24-7-8-25-23(20(24)3)9-10-29-25/h4,6-10,17-19,29H,5,11-15H2,1-3H3,(H,28,30)/b6-4+
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n/an/a 11n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35159
PNG
(5-vinyl-3-pyridinecarbonitrile, 41)
Show SMILES CCS(=O)(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6O2S/c1-3-34(32,33)31-14-12-30(13-15-31)11-5-4-6-20-17-27-18-21(16-26)25(20)29-23-7-8-24-22(19(23)2)9-10-28-24/h4,6-10,17-18,28H,3,5,11-15H2,1-2H3,(H,27,29)/b6-4+
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n/an/a 12n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35158
PNG
(5-vinyl-3-pyridinecarbonitrile, 40)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)S(C)(=O)=O)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6O2S/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-4-10-29-11-13-30(14-12-29)33(2,31)32/h3,5-9,16-17,27H,4,10-14H2,1-2H3,(H,26,28)/b5-3+
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n/an/a 12n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35140
PNG
(5-vinyl-3-pyridinecarbonitrile, 22)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H26N6/c1-16-20-7-9-27-22(20)6-5-21(16)28-23-17(13-26-14-18(23)12-24)4-2-3-10-29-11-8-19(25)15-29/h2,4-7,9,13-14,19,27H,3,8,10-11,15,25H2,1H3,(H,26,28)/b4-2+/t19-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35126
PNG
(5-vinyl-3-pyridinecarbonitrile, 13b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H26N6/c1-17-20-7-8-27-22(20)6-5-21(17)28-23-18(15-26-16-19(23)14-24)4-2-3-11-29-12-9-25-10-13-29/h2,4-8,15-16,25,27H,3,9-13H2,1H3,(H,26,28)/b4-2+
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n/an/a 16n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35142
PNG
(5-vinyl-3-pyridinecarbonitrile, 24)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)NS(C)(=O)=O)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6O2S/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-4-12-31-13-9-21(10-14-31)30-34(2,32)33/h3,5-8,11,16-17,21,28,30H,4,9-10,12-14H2,1-2H3,(H,27,29)/b5-3+
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n/an/a 16n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35120
PNG
(5-vinyl-3-pyridinecarbonitrile, 11b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5O/c1-17-20-7-8-26-22(20)6-5-21(17)27-23-18(15-25-16-19(23)14-24)4-2-3-9-28-10-12-29-13-11-28/h2,4-8,15-16,26H,3,9-13H2,1H3,(H,25,27)/b4-2+
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n/an/a 16n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35164
PNG
(5-vinyl-3-pyridinecarbonitrile, 47)
Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\CCN1CCNCC1
Show InChI InChI=1S/C24H28N6/c1-17-20-8-9-27-23(20)7-6-22(17)29-24-19(15-25)16-28-18(2)21(24)5-3-4-12-30-13-10-26-11-14-30/h3,5-9,16,26-27H,4,10-14H2,1-2H3,(H,28,29)/b5-3+
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n/an/a 17n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35130
PNG
(5-vinyl-3-pyridinecarbonitrile, 14c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(N)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6/c1-18-22-8-11-29-24(22)7-6-23(18)30-25-19(16-28-17-20(25)15-26)5-3-2-4-12-31-13-9-21(27)10-14-31/h3,5-8,11,16-17,21,29H,2,4,9-10,12-14,27H2,1H3,(H,28,30)/b5-3+
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n/an/a 18n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35141
PNG
(5-vinyl-3-pyridinecarbonitrile, 23)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H26N6/c1-16-20-7-9-27-22(20)6-5-21(16)28-23-17(13-26-14-18(23)12-24)4-2-3-10-29-11-8-19(25)15-29/h2,4-7,9,13-14,19,27H,3,8,10-11,15,25H2,1H3,(H,26,28)/b4-2+/t19-/m0/s1
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n/an/a 18n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35118
PNG
(5-vinyl-3-pyridinecarbonitrile, 4c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5/c1-19-22-11-12-28-24(22)10-9-23(19)29-25-20(17-27-18-21(25)16-26)8-4-2-5-13-30-14-6-3-7-15-30/h4,8-12,17-18,28H,2-3,5-7,13-15H2,1H3,(H,27,29)/b8-4+
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PubMed
n/an/a 19n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35149
PNG
(5-vinyl-3-pyridinecarbonitrile, 31)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H31N5/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-25(20-32-21-26(30)19-31)9-5-6-16-35-17-13-24(14-18-35)23-7-3-2-4-8-23/h2-5,7-12,15,20-21,24,33H,6,13-14,16-18H2,1H3,(H,32,34)/b9-5+
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n/an/a 19n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35143
PNG
(5-vinyl-3-pyridinecarbonitrile, 25)
Show SMILES CCS(=O)(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6O2S/c1-3-35(33,34)31-22-10-14-32(15-11-22)13-5-4-6-20-17-28-18-21(16-27)26(20)30-24-7-8-25-23(19(24)2)9-12-29-25/h4,6-9,12,17-18,22,29,31H,3,5,10-11,13-15H2,1-2H3,(H,28,30)/b6-4+
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n/an/a 22n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35144
PNG
(5-vinyl-3-pyridinecarbonitrile, 26)
Show SMILES CC(C)S(=O)(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C27H34N6O2S/c1-19(2)36(34,35)32-23-10-14-33(15-11-23)13-5-4-6-21-17-29-18-22(16-28)27(21)31-25-7-8-26-24(20(25)3)9-12-30-26/h4,6-9,12,17-19,23,30,32H,5,10-11,13-15H2,1-3H3,(H,29,31)/b6-4+
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n/an/a 22n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35125
PNG
(5-vinyl-3-pyridinecarbonitrile, 13a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H24N6/c1-16-19-6-7-26-21(19)5-4-20(16)27-22-17(14-25-15-18(22)13-23)3-2-10-28-11-8-24-9-12-28/h2-7,14-15,24,26H,8-12H2,1H3,(H,25,27)/b3-2+
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n/an/a 22n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35145
PNG
(5-vinyl-3-pyridinecarbonitrile, 27)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)NS(=O)(=O)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H32N6O2S/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-23(20-32-21-24(30)19-31)7-5-6-16-36-17-13-25(14-18-36)35-39(37,38)26-8-3-2-4-9-26/h2-5,7-12,15,20-21,25,33,35H,6,13-14,16-18H2,1H3,(H,32,34)/b7-5+
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n/an/a 23n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35150
PNG
(5-vinyl-3-pyridinecarbonitrile, 32)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H25N5O/c1-16-20-7-9-26-22(20)6-5-21(16)27-23-17(13-25-14-18(23)12-24)4-2-3-10-28-11-8-19(29)15-28/h2,4-7,9,13-14,19,26,29H,3,8,10-11,15H2,1H3,(H,25,27)/b4-2+/t19-/m0/s1
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n/an/a 24n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35137
PNG
(5-vinyl-3-pyridinecarbonitrile, 19)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H28N6/c1-17-21-9-10-28-23(21)8-7-22(17)29-24-18(14-27-15-19(24)13-25)5-2-3-11-30-12-4-6-20(26)16-30/h2,5,7-10,14-15,20,28H,3-4,6,11-12,16,26H2,1H3,(H,27,29)/b5-2+/t20-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35127
PNG
(5-vinyl-3-pyridinecarbonitrile, 13c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-18-21-8-9-28-23(21)7-6-22(18)29-24-19(16-27-17-20(24)15-25)5-3-2-4-12-30-13-10-26-11-14-30/h3,5-9,16-17,26,28H,2,4,10-14H2,1H3,(H,27,29)/b5-3+
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n/an/a 27n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35134
PNG
(5-vinyl-3-pyridinecarbonitrile, 16)
Show SMILES CNC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6/c1-18-22-8-11-29-24(22)7-6-23(18)30-25-19(16-28-17-20(25)15-26)5-3-4-12-31-13-9-21(27-2)10-14-31/h3,5-8,11,16-17,21,27,29H,4,9-10,12-14H2,1-2H3,(H,28,30)/b5-3+
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n/an/a 28n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35138
PNG
(5-vinyl-3-pyridinecarbonitrile, 20)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@H](N)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H28N6/c1-17-21-9-10-28-23(21)8-7-22(17)29-24-18(14-27-15-19(24)13-25)5-2-3-11-30-12-4-6-20(26)16-30/h2,5,7-10,14-15,20,28H,3-4,6,11-12,16,26H2,1H3,(H,27,29)/b5-2+/t20-/m0/s1
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n/an/a 29n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35122
PNG
(5-vinyl-3-pyridinecarbonitrile, 12a)
Show SMILES CN1CCN(C\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C23H26N6/c1-17-20-7-8-26-22(20)6-5-21(17)27-23-18(15-25-16-19(23)14-24)4-3-9-29-12-10-28(2)11-13-29/h3-8,15-16,26H,9-13H2,1-2H3,(H,25,27)/b4-3+
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n/an/a 31n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35146
PNG
(5-vinyl-3-pyridinecarbonitrile, 28)
Show SMILES CC(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H30N6O/c1-18-23-8-11-29-25(23)7-6-24(18)31-26-20(16-28-17-21(26)15-27)5-3-4-12-32-13-9-22(10-14-32)30-19(2)33/h3,5-8,11,16-17,22,29H,4,9-10,12-14H2,1-2H3,(H,28,31)(H,30,33)/b5-3+
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n/an/a 31n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35136
PNG
(5-vinyl-3-pyridinecarbonitrile, 18)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CN)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6/c1-18-22-7-10-29-24(22)6-5-23(18)30-25-20(16-28-17-21(25)15-27)4-2-3-11-31-12-8-19(14-26)9-13-31/h2,4-7,10,16-17,19,29H,3,8-9,11-14,26H2,1H3,(H,28,30)/b4-2+
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n/an/a 33n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35121
PNG
(5-vinyl-3-pyridinecarbonitrile, 11c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5O/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-2-4-10-29-11-13-30-14-12-29/h3,5-9,16-17,27H,2,4,10-14H2,1H3,(H,26,28)/b5-3+
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n/an/a 34n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35117
PNG
(5-vinyl-3-pyridinecarbonitrile, 4b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5/c1-18-21-10-11-27-23(21)9-8-22(18)28-24-19(16-26-17-20(24)15-25)7-3-6-14-29-12-4-2-5-13-29/h3,7-11,16-17,27H,2,4-6,12-14H2,1H3,(H,26,28)/b7-3+
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n/an/a 35n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35156
PNG
(5-vinyl-3-pyridinecarbonitrile, 38)
Show SMILES CC(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H28N6O/c1-18-22-8-9-28-24(22)7-6-23(18)29-25-20(16-27-17-21(25)15-26)5-3-4-10-30-11-13-31(14-12-30)19(2)32/h3,5-9,16-17,28H,4,10-14H2,1-2H3,(H,27,29)/b5-3+
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n/an/a 38n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35148
PNG
(5-vinyl-3-pyridinecarbonitrile, 30)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CO)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-7-10-28-24(22)6-5-23(18)29-25-20(15-27-16-21(25)14-26)4-2-3-11-30-12-8-19(17-31)9-13-30/h2,4-7,10,15-16,19,28,31H,3,8-9,11-13,17H2,1H3,(H,27,29)/b4-2+
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n/an/a 39n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35147
PNG
(5-vinyl-3-pyridinecarbonitrile, 29)
Show SMILES COC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-4-12-30-13-9-21(31-2)10-14-30/h3,5-8,11,16-17,21,28H,4,9-10,12-14H2,1-2H3,(H,27,29)/b5-3+
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PubMed
n/an/a 42n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35122
PNG
(5-vinyl-3-pyridinecarbonitrile, 12a)
Show SMILES CN1CCN(C\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C23H26N6/c1-17-20-7-8-26-22(20)6-5-21(17)27-23-18(15-25-16-19(23)14-24)4-3-9-29-12-10-28(2)11-13-29/h3-8,15-16,26H,9-13H2,1-2H3,(H,25,27)/b4-3+
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PubMed
n/an/a 43n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35124
PNG
(5-vinyl-3-pyridinecarbonitrile, 12c)
Show SMILES CN1CCN(CCC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6/c1-19-22-9-10-28-24(22)8-7-23(19)29-25-20(17-27-18-21(25)16-26)6-4-3-5-11-31-14-12-30(2)13-15-31/h4,6-10,17-18,28H,3,5,11-15H2,1-2H3,(H,27,29)/b6-4+
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n/an/a 45n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35162
PNG
(5-vinyl-3-pyridinecarbonitrile, 45)
Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\CCN1CCC(N)CC1
Show InChI InChI=1S/C25H30N6/c1-17-21-8-11-28-24(21)7-6-23(17)30-25-19(15-26)16-29-18(2)22(25)5-3-4-12-31-13-9-20(27)10-14-31/h3,5-8,11,16,20,28H,4,9-10,12-14,27H2,1-2H3,(H,29,30)/b5-3+
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PubMed
n/an/a 46n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35161
PNG
(5-vinyl-3-pyridinecarbonitrile, 43)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)S(=O)(=O)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C29H30N6O2S/c1-22-26-12-13-32-28(26)11-10-27(22)33-29-23(20-31-21-24(29)19-30)7-5-6-14-34-15-17-35(18-16-34)38(36,37)25-8-3-2-4-9-25/h2-5,7-13,20-21,32H,6,14-18H2,1H3,(H,31,33)/b7-5+
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n/an/a 50n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35157
PNG
(5-vinyl-3-pyridinecarbonitrile, 39)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)C(=O)C(C)(C)C)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H34N6O/c1-20-23-10-11-31-25(23)9-8-24(20)32-26-21(18-30-19-22(26)17-29)7-5-6-12-33-13-15-34(16-14-33)27(35)28(2,3)4/h5,7-11,18-19,31H,6,12-16H2,1-4H3,(H,30,32)/b7-5+
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n/an/a 51n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35119
PNG
(5-vinyl-3-pyridinecarbonitrile, 11a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H23N5O/c1-16-19-6-7-25-21(19)5-4-20(16)26-22-17(14-24-15-18(22)13-23)3-2-8-27-9-11-28-12-10-27/h2-7,14-15,25H,8-12H2,1H3,(H,24,26)/b3-2+
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n/an/a 51n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35135
PNG
(5-vinyl-3-pyridinecarbonitrile, 17)
Show SMILES CN(C)C1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6/c1-19-23-9-12-29-25(23)8-7-24(19)30-26-20(17-28-18-21(26)16-27)6-4-5-13-32-14-10-22(11-15-32)31(2)3/h4,6-9,12,17-18,22,29H,5,10-11,13-15H2,1-3H3,(H,28,30)/b6-4+
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n/an/a 56n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35154
PNG
(5-vinyl-3-pyridinecarbonitrile, 36)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCCNCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6/c1-18-21-8-10-28-23(21)7-6-22(18)29-24-19(16-27-17-20(24)15-25)5-2-3-12-30-13-4-9-26-11-14-30/h2,5-8,10,16-17,26,28H,3-4,9,11-14H2,1H3,(H,27,29)/b5-2+
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PubMed
n/an/a 56n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35163
PNG
(5-vinyl-3-pyridinecarbonitrile, 46)
Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\CCN1CCC(CC1)NS(C)(=O)=O
Show InChI InChI=1S/C26H32N6O2S/c1-18-22-9-12-28-25(22)8-7-24(18)30-26-20(16-27)17-29-19(2)23(26)6-4-5-13-32-14-10-21(11-15-32)31-35(3,33)34/h4,6-9,12,17,21,28,31H,5,10-11,13-15H2,1-3H3,(H,29,30)/b6-4+
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n/an/a 57n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35133
PNG
(5-vinyl-3-pyridinecarbonitrile, 15c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-2-4-12-30-13-9-21(31)10-14-30/h3,5-8,11,16-17,21,28,31H,2,4,9-10,12-14H2,1H3,(H,27,29)/b5-3+
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PubMed
n/an/a 62n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35119
PNG
(5-vinyl-3-pyridinecarbonitrile, 11a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H23N5O/c1-16-19-6-7-25-21(19)5-4-20(16)26-22-17(14-24-15-18(22)13-23)3-2-8-27-9-11-28-12-10-27/h2-7,14-15,25H,8-12H2,1H3,(H,24,26)/b3-2+
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n/an/a 67n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35155
PNG
(5-vinyl-3-pyridinecarbonitrile, 37)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C29H30N6/c1-22-26-12-13-32-28(26)11-10-27(22)33-29-23(20-31-21-24(29)19-30)7-5-6-14-34-15-17-35(18-16-34)25-8-3-2-4-9-25/h2-5,7-13,20-21,32H,6,14-18H2,1H3,(H,31,33)/b7-5+
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n/an/a 68n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35153
PNG
(5-vinyl-3-pyridinecarbonitrile, 35)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H27N5O/c1-17-21-9-10-27-23(21)8-7-22(17)28-24-18(14-26-15-19(24)13-25)5-2-3-11-29-12-4-6-20(30)16-29/h2,5,7-10,14-15,20,27,30H,3-4,6,11-12,16H2,1H3,(H,26,28)/b5-2+/t20-/m1/s1
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PubMed
n/an/a 71n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35149
PNG
(5-vinyl-3-pyridinecarbonitrile, 31)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H31N5/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-25(20-32-21-26(30)19-31)9-5-6-16-35-17-13-24(14-18-35)23-7-3-2-4-8-23/h2-5,7-12,15,20-21,24,33H,6,13-14,16-18H2,1H3,(H,32,34)/b9-5+
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n/an/a 77n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35160
PNG
(5-vinyl-3-pyridinecarbonitrile, 42)
Show SMILES CC(C)S(=O)(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6O2S/c1-19(2)35(33,34)32-14-12-31(13-15-32)11-5-4-6-21-17-28-18-22(16-27)26(21)30-24-7-8-25-23(20(24)3)9-10-29-25/h4,6-10,17-19,29H,5,11-15H2,1-3H3,(H,28,30)/b6-4+
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n/an/a 81n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35118
PNG
(5-vinyl-3-pyridinecarbonitrile, 4c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5/c1-19-22-11-12-28-24(22)10-9-23(19)29-25-20(17-27-18-21(25)16-26)8-4-2-5-13-30-14-6-3-7-15-30/h4,8-12,17-18,28H,2-3,5-7,13-15H2,1H3,(H,27,29)/b8-4+
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n/an/a 94n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35152
PNG
(5-vinyl-3-pyridinecarbonitrile, 34)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H27N5O/c1-17-21-9-10-27-23(21)8-7-22(17)28-24-18(14-26-15-19(24)13-25)5-2-3-11-29-12-4-6-20(30)16-29/h2,5,7-10,14-15,20,27,30H,3-4,6,11-12,16H2,1H3,(H,26,28)/b5-2+/t20-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35151
PNG
(5-vinyl-3-pyridinecarbonitrile, 33)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H25N5O/c1-16-20-7-9-26-22(20)6-5-21(16)27-23-17(13-25-14-18(23)12-24)4-2-3-10-28-11-8-19(29)15-28/h2,4-7,9,13-14,19,26,29H,3,8,10-11,15H2,1H3,(H,25,27)/b4-2+/t19-/m1/s1
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35150
PNG
(5-vinyl-3-pyridinecarbonitrile, 32)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC[C@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C23H25N5O/c1-16-20-7-9-26-22(20)6-5-21(16)27-23-17(13-25-14-18(23)12-24)4-2-3-10-28-11-8-19(29)15-28/h2,4-7,9,13-14,19,26,29H,3,8,10-11,15H2,1H3,(H,25,27)/b4-2+/t19-/m0/s1
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35121
PNG
(5-vinyl-3-pyridinecarbonitrile, 11c)
Show SMILES Cc1c(Nc2c(\C=C\CCCN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5O/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-2-4-10-29-11-13-30-14-12-29/h3,5-9,16-17,27H,2,4,10-14H2,1H3,(H,26,28)/b5-3+
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35139
PNG
(5-vinyl-3-pyridinecarbonitrile, 21)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CC(N)C3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C22H24N6/c1-15-19-7-8-26-21(19)6-5-20(15)27-22-16(11-25-12-17(22)10-23)4-2-3-9-28-13-18(24)14-28/h2,4-8,11-12,18,26H,3,9,13-14,24H2,1H3,(H,25,27)/b4-2+
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35164
PNG
(5-vinyl-3-pyridinecarbonitrile, 47)
Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\CCN1CCNCC1
Show InChI InChI=1S/C24H28N6/c1-17-20-8-9-27-23(20)7-6-22(17)29-24-19(15-25)16-28-18(2)21(24)5-3-4-12-30-13-10-26-11-14-30/h3,5-9,16,26-27H,4,10-14H2,1-2H3,(H,28,29)/b5-3+
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35131
PNG
(5-vinyl-3-pyridinecarbonitrile, 15a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5O/c1-16-20-6-9-26-22(20)5-4-21(16)27-23-17(14-25-15-18(23)13-24)3-2-10-28-11-7-19(29)8-12-28/h2-6,9,14-15,19,26,29H,7-8,10-12H2,1H3,(H,25,27)/b3-2+
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n/an/a 140n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35148
PNG
(5-vinyl-3-pyridinecarbonitrile, 30)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CO)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H29N5O/c1-18-22-7-10-28-24(22)6-5-23(18)29-25-20(15-27-16-21(25)14-26)4-2-3-11-30-12-8-19(17-31)9-13-30/h2,4-7,10,15-16,19,28,31H,3,8-9,11-13,17H2,1H3,(H,27,29)/b4-2+
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n/an/a 140n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35132
PNG
(5-vinyl-3-pyridinecarbonitrile, 15b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5O/c1-17-21-7-10-27-23(21)6-5-22(17)28-24-18(15-26-16-19(24)14-25)4-2-3-11-29-12-8-20(30)9-13-29/h2,4-7,10,15-16,20,27,30H,3,8-9,11-13H2,1H3,(H,26,28)/b4-2+
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n/an/a 180n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (Human))
BDBM35116
PNG
(5-vinyl-3-pyridinecarbonitrile, 4a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5/c1-17-20-9-10-26-22(20)8-7-21(17)27-23-18(15-25-16-19(23)14-24)6-5-13-28-11-3-2-4-12-28/h5-10,15-16,26H,2-4,11-13H2,1H3,(H,25,27)/b6-5+
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n/an/a 190n/an/an/an/a7.222



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35142
PNG
(5-vinyl-3-pyridinecarbonitrile, 24)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)NS(C)(=O)=O)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C25H30N6O2S/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-4-12-31-13-9-21(10-14-31)30-34(2,32)33/h3,5-8,11,16-17,21,28,30H,4,9-10,12-14H2,1-2H3,(H,27,29)/b5-3+
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n/an/a 200n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35145
PNG
(5-vinyl-3-pyridinecarbonitrile, 27)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC(CC3)NS(=O)(=O)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C30H32N6O2S/c1-22-27-12-15-33-29(27)11-10-28(22)34-30-23(20-32-21-24(30)19-31)7-5-6-16-36-17-13-25(14-18-36)35-39(37,38)26-8-3-2-4-9-26/h2-5,7-12,15,20-21,25,33,35H,6,13-14,16-18H2,1H3,(H,32,34)/b7-5+
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n/an/a 200n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35147
PNG
(5-vinyl-3-pyridinecarbonitrile, 29)
Show SMILES COC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H29N5O/c1-18-22-8-11-28-24(22)7-6-23(18)29-25-19(16-27-17-20(25)15-26)5-3-4-12-30-13-9-21(31-2)10-14-30/h3,5-8,11,16-17,21,28H,4,9-10,12-14H2,1-2H3,(H,27,29)/b5-3+
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n/an/a 220n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35143
PNG
(5-vinyl-3-pyridinecarbonitrile, 25)
Show SMILES CCS(=O)(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H32N6O2S/c1-3-35(33,34)31-22-10-14-32(15-11-22)13-5-4-6-20-17-28-18-21(16-27)26(20)30-24-7-8-25-23(19(24)2)9-12-29-25/h4,6-9,12,17-18,22,29,31H,3,5,10-11,13-15H2,1-2H3,(H,28,30)/b6-4+
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n/an/a 240n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35158
PNG
(5-vinyl-3-pyridinecarbonitrile, 40)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)S(C)(=O)=O)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H28N6O2S/c1-18-21-8-9-27-23(21)7-6-22(18)28-24-19(16-26-17-20(24)15-25)5-3-4-10-29-11-13-30(14-12-29)33(2,31)32/h3,5-9,16-17,27H,4,10-14H2,1-2H3,(H,26,28)/b5-3+
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n/an/a 240n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35120
PNG
(5-vinyl-3-pyridinecarbonitrile, 11b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCOCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5O/c1-17-20-7-8-26-22(20)6-5-21(17)27-23-18(15-25-16-19(23)14-24)4-2-3-9-28-10-12-29-13-11-28/h2,4-8,15-16,26H,3,9-13H2,1H3,(H,25,27)/b4-2+
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n/an/a 250n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35163
PNG
(5-vinyl-3-pyridinecarbonitrile, 46)
Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\CCN1CCC(CC1)NS(C)(=O)=O
Show InChI InChI=1S/C26H32N6O2S/c1-18-22-9-12-28-25(22)8-7-24(18)30-26-20(16-27)17-29-19(2)23(26)6-4-5-13-32-14-10-21(11-15-32)31-35(3,33)34/h4,6-9,12,17,21,28,31H,5,10-11,13-15H2,1-3H3,(H,29,30)/b6-4+
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n/an/a 250n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35117
PNG
(5-vinyl-3-pyridinecarbonitrile, 4b)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C24H27N5/c1-18-21-10-11-27-23(21)9-8-22(18)28-24-19(16-26-17-20(24)15-25)7-3-6-14-29-12-4-2-5-13-29/h3,7-11,16-17,27H,2,4-6,12-14H2,1H3,(H,26,28)/b7-3+
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n/an/a 260n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35159
PNG
(5-vinyl-3-pyridinecarbonitrile, 41)
Show SMILES CCS(=O)(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H30N6O2S/c1-3-34(32,33)31-14-12-30(13-15-31)11-5-4-6-20-17-27-18-21(16-26)25(20)29-23-7-8-24-22(19(23)2)9-10-28-24/h4,6-10,17-18,28H,3,5,11-15H2,1-2H3,(H,27,29)/b6-4+
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n/an/a 270n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35144
PNG
(5-vinyl-3-pyridinecarbonitrile, 26)
Show SMILES CC(C)S(=O)(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C27H34N6O2S/c1-19(2)36(34,35)32-23-10-14-33(15-11-23)13-5-4-6-21-17-29-18-22(16-28)27(21)31-25-7-8-26-24(20(25)3)9-12-30-26/h4,6-9,12,17-19,23,30,32H,5,10-11,13-15H2,1-3H3,(H,29,31)/b6-4+
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n/an/a 290n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35146
PNG
(5-vinyl-3-pyridinecarbonitrile, 28)
Show SMILES CC(=O)NC1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C26H30N6O/c1-18-23-8-11-29-25(23)7-6-24(18)31-26-20(16-28-17-21(26)15-27)5-3-4-12-32-13-9-22(10-14-32)30-19(2)33/h3,5-8,11,16-17,22,29H,4,9-10,12-14H2,1-2H3,(H,28,31)(H,30,33)/b5-3+
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PubMed
n/an/a 310n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35156
PNG
(5-vinyl-3-pyridinecarbonitrile, 38)
Show SMILES CC(=O)N1CCN(CC\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)CC1
Show InChI InChI=1S/C25H28N6O/c1-18-22-8-9-28-24(22)7-6-23(18)29-25-20(16-27-17-21(25)15-26)5-3-4-10-30-11-13-31(14-12-30)19(2)32/h3,5-9,16-17,28H,4,10-14H2,1-2H3,(H,27,29)/b5-3+
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PubMed
n/an/a 390n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35161
PNG
(5-vinyl-3-pyridinecarbonitrile, 43)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)S(=O)(=O)c3ccccc3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C29H30N6O2S/c1-22-26-12-13-32-28(26)11-10-27(22)33-29-23(20-31-21-24(29)19-30)7-5-6-14-34-15-17-35(18-16-34)38(36,37)25-8-3-2-4-9-25/h2-5,7-13,20-21,32H,6,14-18H2,1H3,(H,31,33)/b7-5+
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PubMed
n/an/a 410n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35116
PNG
(5-vinyl-3-pyridinecarbonitrile, 4a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCCCC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5/c1-17-20-9-10-26-22(20)8-7-21(17)27-23-18(15-25-16-19(23)14-24)6-5-13-28-11-3-2-4-12-28/h5-10,15-16,26H,2-4,11-13H2,1H3,(H,25,27)/b6-5+
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PubMed
n/an/a 690n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35131
PNG
(5-vinyl-3-pyridinecarbonitrile, 15a)
Show SMILES Cc1c(Nc2c(\C=C\CN3CCC(O)CC3)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C23H25N5O/c1-16-20-6-9-26-22(20)5-4-21(16)27-23-17(14-25-15-18(23)13-24)3-2-10-28-11-7-19(29)8-12-28/h2-6,9,14-15,19,26,29H,7-8,10-12H2,1H3,(H,25,27)/b3-2+
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PubMed
n/an/a 760n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35153
PNG
(5-vinyl-3-pyridinecarbonitrile, 35)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H27N5O/c1-17-21-9-10-27-23(21)8-7-22(17)28-24-18(14-26-15-19(24)13-25)5-2-3-11-29-12-4-6-20(30)16-29/h2,5,7-10,14-15,20,27,30H,3-4,6,11-12,16H2,1H3,(H,26,28)/b5-2+/t20-/m1/s1
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Article
PubMed
n/an/a 930n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35152
PNG
(5-vinyl-3-pyridinecarbonitrile, 34)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCC[C@H](O)C3)cncc2C#N)ccc2[nH]ccc12 |r|
Show InChI InChI=1S/C24H27N5O/c1-17-21-9-10-27-23(21)8-7-22(17)28-24-18(14-26-15-19(24)13-25)5-2-3-11-29-12-4-6-20(30)16-29/h2,5,7-10,14-15,20,27,30H,3-4,6,11-12,16H2,1H3,(H,26,28)/b5-2+/t20-/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM35157
PNG
(5-vinyl-3-pyridinecarbonitrile, 39)
Show SMILES Cc1c(Nc2c(\C=C\CCN3CCN(CC3)C(=O)C(C)(C)C)cncc2C#N)ccc2[nH]ccc12
Show InChI InChI=1S/C28H34N6O/c1-20-23-10-11-31-25(23)9-8-24(20)32-26-21(18-30-19-22(26)17-29)7-5-6-12-33-13-15-34(16-14-33)27(35)28(2,3)4/h5,7-11,18-19,31H,6,12-16H2,1-4H3,(H,30,32)/b7-5+
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Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Wyeth Research



Assay Description
All IC50s were measured by using a modified IMAP protocol from Molecular Devices. The kinase reaction was carried out in a Corning Costar 384 well pl...


Bioorg Med Chem 17: 7933-48 (2009)


Article DOI: 10.1016/j.bmc.2009.10.020
BindingDB Entry DOI: 10.7270/Q2M043RT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%