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Compile Data Set for Download or QSAR

Found 8054 hits Enz. Inhib. hit(s) with Target = 'Protein Kinase C'   
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
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM14027
PNG
(5-(1,4-diazepan-1-ylsulfonyl)isoquinoline | 5-(1,4...)
Show SMILES O=S(=O)(N1CCCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2
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PubMed
n/an/a 1.49E+3n/an/an/an/a6.825



German Cancer Research Center



Assay Description
The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...


J Biol Chem 281: 24818-30 (2006)


Article DOI: 10.1074/jbc.M512374200
BindingDB Entry DOI: 10.7270/Q2PG1PZV
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM14028
PNG
((S)-2-METHYL-1-[(4-METHYL-5-ISOQUINOLINE)SULFONYL]...)
Show SMILES C[C@H]1CNCCCN1S(=O)(=O)c1cccc2cncc(C)c12
Show InChI InChI=1S/C16H21N3O2S/c1-12-9-18-11-14-5-3-6-15(16(12)14)22(20,21)19-8-4-7-17-10-13(19)2/h3,5-6,9,11,13,17H,4,7-8,10H2,1-2H3/t13-/m0/s1
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n/an/a 394n/an/an/an/a6.825



German Cancer Research Center



Assay Description
The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...


J Biol Chem 281: 24818-30 (2006)


Article DOI: 10.1074/jbc.M512374200
BindingDB Entry DOI: 10.7270/Q2PG1PZV
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM2579
PNG
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)
Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1
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n/an/a<45n/an/an/an/a6.825



German Cancer Research Center



Assay Description
The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...


J Biol Chem 281: 24818-30 (2006)


Article DOI: 10.1074/jbc.M512374200
BindingDB Entry DOI: 10.7270/Q2PG1PZV
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM14030
PNG
(KT5720 | hexyl (15R,16S,18S)-16-hydroxy-15-methyl-...)
Show SMILES CCCCCCOC(=O)[C@]1(O)C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1S/C32H31N3O5/c1-3-4-5-10-15-39-30(37)32(38)16-23-34-21-13-8-6-11-18(21)25-26-20(17-33-29(26)36)24-19-12-7-9-14-22(19)35(28(24)27(25)34)31(32,2)40-23/h6-9,11-14,23,38H,3-5,10,15-17H2,1-2H3,(H,33,36)/t23-,31+,32+/m0/s1
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n/an/a 56n/an/an/an/a6.825



German Cancer Research Center



Assay Description
The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...


J Biol Chem 281: 24818-30 (2006)


Article DOI: 10.1074/jbc.M512374200
BindingDB Entry DOI: 10.7270/Q2PG1PZV
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM14029
PNG
((R)-TRANS-4-(1-AMINOETHYL)-N-(4-PYRIDYL) CYCLOHEXA...)
Show SMILES C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C14H21N3O/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13/h6-12H,2-5,15H2,1H3,(H,16,17,18)/t10-,11-,12-/m1/s1
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PubMed
n/an/a 4.20E+4n/an/an/an/a6.825



German Cancer Research Center



Assay Description
The enzyme activity was assayed by using an ATP regenerative NADH consuming system. The reaction was started with adding ATP to the mixture containin...


J Biol Chem 281: 24818-30 (2006)


Article DOI: 10.1074/jbc.M512374200
BindingDB Entry DOI: 10.7270/Q2PG1PZV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25558
PNG
(4-arylamino-3-pyridinecarbonitrile, 4p | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C22H18N4O2/c1-27-20-6-3-14(10-21(20)28-2)18-13-24-12-16(11-23)22(18)26-17-4-5-19-15(9-17)7-8-25-19/h3-10,12-13,25H,1-2H3,(H,24,26)
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79 -40.1 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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25543
PNG
(4-[(3-bromophenyl)amino]-5-(3,4-dimethoxyphenyl)py...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc(Br)c1
Show InChI InChI=1S/C20H16BrN3O2/c1-25-18-7-6-13(8-19(18)26-2)17-12-23-11-14(10-22)20(17)24-16-5-3-4-15(21)9-16/h3-9,11-12H,1-2H3,(H,23,24)
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4.90E+3 -30.0 4.60E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM15204
PNG
(Isoquinoline-5-sulfonic acid piperidin-4-ylamide |...)
Show SMILES O=S(=O)(NC1CCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C14H17N3O2S/c18-20(19,17-12-4-7-15-8-5-12)14-3-1-2-11-10-16-9-6-13(11)14/h1-3,6,9-10,12,15,17H,4-5,7-8H2
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n/an/a 3.90E+3n/an/an/an/a7.222



UK Centre for Cancer Therapeutics



Assay Description
The recombinant alpha catalytic subunit of bovine PKA was assayed with a peptide substrate and test compound in the presence of 40 uM ATP/ [gamma-33P...


Bioorg Med Chem 14: 1255-73 (2006)


Article DOI: 10.1016/j.bmc.2005.09.055
BindingDB Entry DOI: 10.7270/Q2FN14F2
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM15131
PNG
(5-indazolyl pyridine 3 | 5-{5-[(2S)-2-amino-3-(1H-...)
Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C24H23N5O/c1-15-22-10-16(6-7-24(22)29-28-15)17-9-20(13-26-11-17)30-14-19(25)8-18-12-27-23-5-3-2-4-21(18)23/h2-7,9-13,19,27H,8,14,25H2,1H3,(H,28,29)/t19-/m0/s1
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n/an/a 27n/an/an/an/a7.222



Astex



Assay Description
The recombinant alpha catalytic subunit of bovine PKA was assayed with a peptide substrate and test compound in the presence of 40 uM ATP/ [gamma-33P...


J Mol Biol 367: 882-94 (2007)


Article DOI: 10.1016/j.jmb.2007.01.004
BindingDB Entry DOI: 10.7270/Q29Z934H
More data for this
Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA)


(Bos taurus (bovine))
BDBM16222
PNG
(CCT077373 | N-[2-({2-[(4-chlorobenzyl)oxy]ethyl}am...)
Show SMILES Clc1ccc(COCCNCCNS(=O)(=O)c2cccc3cnccc23)cc1
Show InChI InChI=1S/C20H22ClN3O3S/c21-18-6-4-16(5-7-18)15-27-13-12-22-10-11-24-28(25,26)20-3-1-2-17-14-23-9-8-19(17)20/h1-9,14,22,24H,10-13,15H2
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n/an/a 170n/an/an/an/a7.222



Astex



Assay Description
The recombinant alpha catalytic subunit of bovine PKA was assayed with a peptide substrate and test compound in the presence of 40 uM ATP/ [gamma-33P...


J Mol Biol 367: 882-94 (2007)


Article DOI: 10.1016/j.jmb.2007.01.004
BindingDB Entry DOI: 10.7270/Q29Z934H
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25544
PNG
(4-arylamino-3-pyridinecarbonitrile, 4b | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccccc1
Show InChI InChI=1S/C20H17N3O2/c1-24-18-9-8-14(10-19(18)25-2)17-13-22-12-15(11-21)20(17)23-16-6-4-3-5-7-16/h3-10,12-13H,1-2H3,(H,22,23)
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n/an/a 1.60E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25545
PNG
(4-[(3-chlorophenyl)amino]-5-(3,4-dimethoxyphenyl)p...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc(Cl)c1
Show InChI InChI=1S/C20H16ClN3O2/c1-25-18-7-6-13(8-19(18)26-2)17-12-23-11-14(10-22)20(17)24-16-5-3-4-15(21)9-16/h3-9,11-12H,1-2H3,(H,23,24)
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n/an/a 3.90E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25546
PNG
(4-arylamino-3-pyridinecarbonitrile, 4d | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc(F)c1
Show InChI InChI=1S/C20H16FN3O2/c1-25-18-7-6-13(8-19(18)26-2)17-12-23-11-14(10-22)20(17)24-16-5-3-4-15(21)9-16/h3-9,11-12H,1-2H3,(H,23,24)
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n/an/a 1.40E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25547
PNG
(4-arylamino-3-pyridinecarbonitrile, 4e | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C26H21N3O3/c1-30-24-12-11-18(13-25(24)31-2)23-17-28-16-19(15-27)26(23)29-20-7-6-10-22(14-20)32-21-8-4-3-5-9-21/h3-14,16-17H,1-2H3,(H,28,29)
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n/an/a>3.00E+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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25548
PNG
(4-arylamino-3-pyridinecarbonitrile, 4f | 4-{[3-(be...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C27H23N3O3/c1-31-25-12-11-20(13-26(25)32-2)24-17-29-16-21(15-28)27(24)30-22-9-6-10-23(14-22)33-18-19-7-4-3-5-8-19/h3-14,16-17H,18H2,1-2H3,(H,29,30)
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n/an/a>3.00E+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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25549
PNG
(4-[(4-chlorophenyl)amino]-5-(3,4-dimethoxyphenyl)p...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(Cl)cc1
Show InChI InChI=1S/C20H16ClN3O2/c1-25-18-8-3-13(9-19(18)26-2)17-12-23-11-14(10-22)20(17)24-16-6-4-15(21)5-7-16/h3-9,11-12H,1-2H3,(H,23,24)
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n/an/a 2.80E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25550
PNG
(4-arylamino-3-pyridinecarbonitrile, 4h | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(C)cc1
Show InChI InChI=1S/C21H19N3O2/c1-14-4-7-17(8-5-14)24-21-16(11-22)12-23-13-18(21)15-6-9-19(25-2)20(10-15)26-3/h4-10,12-13H,1-3H3,(H,23,24)
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n/an/a 900n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25551
PNG
(4-arylamino-3-pyridinecarbonitrile, 4i | 5-(3,4-di...)
Show SMILES COc1ccc(Nc2c(cncc2-c2ccc(OC)c(OC)c2)C#N)cc1
Show InChI InChI=1S/C21H19N3O3/c1-25-17-7-5-16(6-8-17)24-21-15(11-22)12-23-13-18(21)14-4-9-19(26-2)20(10-14)27-3/h4-10,12-13H,1-3H3,(H,23,24)
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n/an/a 400n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25552
PNG
(4-arylamino-3-pyridinecarbonitrile, 4j | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H21N3O3/c1-30-24-13-8-18(14-25(24)31-2)23-17-28-16-19(15-27)26(23)29-20-9-11-22(12-10-20)32-21-6-4-3-5-7-21/h3-14,16-17H,1-2H3,(H,28,29)
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n/an/a 8.40E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25553
PNG
(4-[(2,4-dichlorophenyl)amino]-5-(3,4-dimethoxyphen...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H15Cl2N3O2/c1-26-18-6-3-12(7-19(18)27-2)15-11-24-10-13(9-23)20(15)25-17-5-4-14(21)8-16(17)22/h3-8,10-11H,1-2H3,(H,24,25)
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n/an/a 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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25554
PNG
(4-arylamino-3-pyridinecarbonitrile, 4l | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(C)cc1C
Show InChI InChI=1S/C22H21N3O2/c1-14-5-7-19(15(2)9-14)25-22-17(11-23)12-24-13-18(22)16-6-8-20(26-3)21(10-16)27-4/h5-10,12-13H,1-4H3,(H,24,25)
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n/an/a 160n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25555
PNG
(4-[(2,5-dichlorophenyl)amino]-5-(3,4-dimethoxyphen...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C20H15Cl2N3O2/c1-26-18-6-3-12(7-19(18)27-2)15-11-24-10-13(9-23)20(15)25-17-8-14(21)4-5-16(17)22/h3-8,10-11H,1-2H3,(H,24,25)
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n/an/a 470n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25556
PNG
(4-[(3,4-dichlorophenyl)amino]-5-(3,4-dimethoxyphen...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C20H15Cl2N3O2/c1-26-18-6-3-12(7-19(18)27-2)15-11-24-10-13(9-23)20(15)25-14-4-5-16(21)17(22)8-14/h3-8,10-11H,1-2H3,(H,24,25)
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n/an/a 2.40E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25557
PNG
(4-arylamino-3-pyridinecarbonitrile, 4o | 5-(3,4-di...)
Show SMILES COc1ccc(Nc2c(cncc2-c2ccc(OC)c(OC)c2)C#N)cc1OC
Show InChI InChI=1S/C22H21N3O4/c1-26-18-7-5-14(9-20(18)28-3)17-13-24-12-15(11-23)22(17)25-16-6-8-19(27-2)21(10-16)29-4/h5-10,12-13H,1-4H3,(H,24,25)
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n/an/a 2.20E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25559
PNG
(4-arylamino-3-pyridinecarbonitrile, 4q | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C22H18N4O2/c1-27-20-6-4-15(9-21(20)28-2)18-13-24-12-16(11-23)22(18)26-17-5-3-14-7-8-25-19(14)10-17/h3-10,12-13,25H,1-2H3,(H,24,26)
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n/an/a 2.20E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25560
PNG
(4-(2,3-dihydro-1H-inden-5-ylamino)-5-(3,4-dimethox...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc2CCCc2c1
Show InChI InChI=1S/C23H21N3O2/c1-27-21-9-7-17(11-22(21)28-2)20-14-25-13-18(12-24)23(20)26-19-8-6-15-4-3-5-16(15)10-19/h6-11,13-14H,3-5H2,1-2H3,(H,25,26)
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n/an/a 2.00E+3n/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...


J Med Chem 51: 5958-63 (2008)


Article DOI: 10.1021/jm800214a
BindingDB Entry DOI: 10.7270/Q21V5C8K
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25558
PNG
(4-arylamino-3-pyridinecarbonitrile, 4p | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C22H18N4O2/c1-27-20-6-3-14(10-21(20)28-2)18-13-24-12-16(11-23)22(18)26-17-4-5-19-15(9-17)7-8-25-19/h3-10,12-13,25H,1-2H3,(H,24,26)
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n/an/a 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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM25559
PNG
(4-arylamino-3-pyridinecarbonitrile, 4q | 5-(3,4-di...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C22H18N4O2/c1-27-20-6-4-15(9-21(20)28-2)18-13-24-12-16(11-23)22(18)26-17-5-3-14-7-8-25-19(14)10-17/h3-10,12-13,25H,1-2H3,(H,24,26)
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n/an/a 2.20E+3n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29816
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 1c...)
Show SMILES COc1ccc(cc1OC)-c1cncc(C#N)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C22H18N4O2/c1-27-20-7-6-14(10-21(20)28-2)17-13-24-12-15(11-23)22(17)26-19-5-3-4-18-16(19)8-9-25-18/h3-10,12-13,25H,1-2H3,(H,24,26)
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n/an/a 13n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29817
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 7a)
Show SMILES COCCOc1cc(ccc1OC)-c1cncc(C#N)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C24H22N4O3/c1-29-10-11-31-23-12-16(6-7-22(23)30-2)19-15-26-14-17(13-25)24(19)28-21-5-3-4-20-18(21)8-9-27-20/h3-9,12,14-15,27H,10-11H2,1-2H3,(H,26,28)
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n/an/a 63n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29818
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 7b)
Show SMILES COCCOc1cc(ccc1OC)-c1cncc(C#N)c1Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C24H22N4O3/c1-29-9-10-31-23-12-16(3-6-22(23)30-2)20-15-26-14-18(13-25)24(20)28-19-4-5-21-17(11-19)7-8-27-21/h3-8,11-12,14-15,27H,9-10H2,1-2H3,(H,26,28)
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n/an/a 320n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29819
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 7c)
Show SMILES COCCOc1cc(ccc1OC)-c1cncc(C#N)c1Nc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C24H22N4O3/c1-29-9-10-31-23-11-17(4-6-22(23)30-2)20-15-26-14-18(13-25)24(20)28-19-5-3-16-7-8-27-21(16)12-19/h3-8,11-12,14-15,27H,9-10H2,1-2H3,(H,26,28)
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n/an/a 6.30E+3n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29820
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 7d)
Show SMILES COCCOc1cccc(c1)-c1cncc(C#N)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C23H20N4O2/c1-28-10-11-29-18-5-2-4-16(12-18)20-15-25-14-17(13-24)23(20)27-22-7-3-6-21-19(22)8-9-26-21/h2-9,12,14-15,26H,10-11H2,1H3,(H,25,27)
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n/an/a 32n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29821
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCCC3)c2)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C26H25N5O/c27-16-20-17-28-18-23(26(20)30-25-8-4-7-24-22(25)9-10-29-24)19-5-3-6-21(15-19)32-14-13-31-11-1-2-12-31/h3-10,15,17-18,29H,1-2,11-14H2,(H,28,30)
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n/an/a 29n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29822
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCCCC3)c2)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C27H27N5O/c28-17-21-18-29-19-24(27(21)31-26-9-5-8-25-23(26)10-11-30-25)20-6-4-7-22(16-20)33-15-14-32-12-2-1-3-13-32/h4-11,16,18-19,30H,1-3,12-15H2,(H,29,31)
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n/an/a 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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29823
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCOCC3)c2)c1Nc1cccc2[nH]ccc12
Show InChI InChI=1S/C26H25N5O2/c27-16-20-17-28-18-23(26(20)30-25-6-2-5-24-22(25)7-8-29-24)19-3-1-4-21(15-19)33-14-11-31-9-12-32-13-10-31/h1-8,15,17-18,29H,9-14H2,(H,28,30)
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n/an/a 17n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29824
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES CN1CCN(CCOc2cccc(c2)-c2cncc(C#N)c2Nc2cccc3[nH]ccc23)CC1
Show InChI InChI=1S/C27H28N6O/c1-32-10-12-33(13-11-32)14-15-34-22-5-2-4-20(16-22)24-19-29-18-21(17-28)27(24)31-26-7-3-6-25-23(26)8-9-30-25/h2-9,16,18-19,30H,10-15H2,1H3,(H,29,31)
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n/an/a 18n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29825
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCCC3)c2)c1Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C26H25N5O/c27-16-21-17-28-18-24(26(21)30-22-6-7-25-20(14-22)8-9-29-25)19-4-3-5-23(15-19)32-13-12-31-10-1-2-11-31/h3-9,14-15,17-18,29H,1-2,10-13H2,(H,28,30)
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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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29826
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCOCC3)c2)c1Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C26H25N5O2/c27-16-21-17-28-18-24(26(21)30-22-4-5-25-20(14-22)6-7-29-25)19-2-1-3-23(15-19)33-13-10-31-8-11-32-12-9-31/h1-7,14-15,17-18,29H,8-13H2,(H,28,30)
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n/an/a 200n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Protein kinase C theta type


(Homo sapiens (human))
BDBM29827
PNG
(4-indolylamino-5-phenyl-3-pyridinecarbonitrile, 12...)
Show SMILES N#Cc1cncc(-c2cccc(OCCN3CCOCC3)c2)c1Nc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C26H25N5O2/c27-16-21-17-28-18-24(26(21)30-22-5-4-19-6-7-29-25(19)15-22)20-2-1-3-23(14-20)33-13-10-31-8-11-32-12-9-31/h1-7,14-15,17-18,29H,8-13H2,(H,28,30)
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n/an/a 9.50E+3n/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 Lett 19: 2461-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.053
BindingDB Entry DOI: 10.7270/Q21R6NVV
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32350
PNG
(MLS000708313 | N-(2-pyrrolidin-1-ylcarbonylphenyl)...)
Show SMILES O=C(Nc1ccccc1C(=O)N1CCCC1)C1COc2ccccc2O1
Show InChI InChI=1S/C20H20N2O4/c23-19(18-13-25-16-9-3-4-10-17(16)26-18)21-15-8-2-1-7-14(15)20(24)22-11-5-6-12-22/h1-4,7-10,18H,5-6,11-13H2,(H,21,23)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32351
PNG
(1-phenyl-2-[(3-pyridin-3-yl-[1,2,4]triazolo[4,3-b]...)
Show SMILES O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)c1ccccc1
Show InChI InChI=1S/C18H13N5OS/c24-15(13-5-2-1-3-6-13)12-25-17-9-8-16-20-21-18(23(16)22-17)14-7-4-10-19-11-14/h1-11H,12H2
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32352
PNG
(2-(3-besylpropanoylimino)-3,4-dimethyl-4-thiazolin...)
Show SMILES CCOC(=O)c1sc(=NC(=O)CCS(=O)(=O)c2ccccc2)n(C)c1C
Show InChI InChI=1S/C17H20N2O5S2/c1-4-24-16(21)15-12(2)19(3)17(25-15)18-14(20)10-11-26(22,23)13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32353
PNG
(3-(2,5-dichlorophenyl)-1,3-thiazolan-4-one | 3-(2,...)
Show SMILES Clc1ccc(Cl)c(c1)N1CSCC1=O
Show InChI InChI=1S/C9H7Cl2NOS/c10-6-1-2-7(11)8(3-6)12-5-14-4-9(12)13/h1-3H,4-5H2
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32354
PNG
(4-(cyclohexanecarbonyl)-1H-pyrrole-2-carboxylic ac...)
Show SMILES OC(=O)c1cc(c[nH]1)C(=O)C1CCCCC1
Show InChI InChI=1S/C12H15NO3/c14-11(8-4-2-1-3-5-8)9-6-10(12(15)16)13-7-9/h6-8,13H,1-5H2,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32355
PNG
(MLS000730065 | N-cyclopentyl-2,4-diketo-3-p-anisyl...)
Show SMILES COc1ccc(Cn2c(=O)[nH]c3cc(ccc3c2=O)C(=O)NC2CCCC2)cc1
Show InChI InChI=1S/C22H23N3O4/c1-29-17-9-6-14(7-10-17)13-25-21(27)18-11-8-15(12-19(18)24-22(25)28)20(26)23-16-4-2-3-5-16/h6-12,16H,2-5,13H2,1H3,(H,23,26)(H,24,28)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32356
PNG
(2-amino-6-chloro-4-methyl-3,5-pyridinedicarbonitri...)
Show SMILES Cc1c(C#N)c(N)nc(Cl)c1C#N
Show InChI InChI=1S/C8H5ClN4/c1-4-5(2-10)7(9)13-8(12)6(4)3-11/h1H3,(H2,12,13)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32357
PNG
(2-(2-furoyl)-N-p-anisyl-3,4-dihydro-1H-isoquinolin...)
Show SMILES COc1ccc(CNC(=O)C2Cc3ccccc3CN2C(=O)c2ccco2)cc1
Show InChI InChI=1S/C23H22N2O4/c1-28-19-10-8-16(9-11-19)14-24-22(26)20-13-17-5-2-3-6-18(17)15-25(20)23(27)21-7-4-12-29-21/h2-12,20H,13-15H2,1H3,(H,24,26)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32358
PNG
(2-chloro-5-(1-piperidinylsulfonyl)benzoic acid [2-...)
Show SMILES Cn1cccc1C(=O)NC(=O)COC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C20H22ClN3O6S/c1-23-9-5-6-17(23)19(26)22-18(25)13-30-20(27)15-12-14(7-8-16(15)21)31(28,29)24-10-3-2-4-11-24/h5-9,12H,2-4,10-11,13H2,1H3,(H,22,25,26)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32359
PNG
(MLS000772778 | N-(2-naphthalenyl)-2-(pyridin-4-ylt...)
Show SMILES O=C(CSc1ccncc1)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C17H14N2OS/c20-17(12-21-16-7-9-18-10-8-16)19-15-6-5-13-3-1-2-4-14(13)11-15/h1-11H,12H2,(H,19,20)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
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