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Compile Data Set for Download or QSAR

Found 594 hits Enz. Inhib. hit(s) with Target = 'CGMP-dependent protein kinase'   
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
cGMP-dependent protein kinase


(Homo sapiens (Human))
BDBM15211
PNG
(CHEMBL104264 | H-89 | H89 | HT-89 (H-89) | N-(2-{[...)
Show SMILES Brc1ccc(\C=C\CNCCNS(=O)(=O)c2cccc3cnccc23)cc1
Show InChI InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+
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480 -36.7n/an/an/an/an/an/a30



Nagoya University School of Medicine



Assay Description
Protein kinase C, cAMP dependent protein kinase, cGMP dependent protein kinase and myosin light chain kinase activity were measure under conditions d...


Citation and Details
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Homo sapiens (Human))
BDBM15211
PNG
(CHEMBL104264 | H-89 | H89 | HT-89 (H-89) | N-(2-{[...)
Show SMILES Brc1ccc(\C=C\CNCCNS(=O)(=O)c2cccc3cnccc23)cc1
Show InChI InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+
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500n/an/an/an/an/an/an/an/a



Temple University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 316: 869-74 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Homo sapiens (Human))
BDBM92607
PNG
(H-88)
Show SMILES O=S(=O)(NCCNC\C=C\c1ccccc1)c1cccc2cnccc12
Show InChI InChI=1S/C20H21N3O2S/c24-26(25,20-10-4-9-18-16-22-13-11-19(18)20)23-15-14-21-12-5-8-17-6-2-1-3-7-17/h1-11,13,16,21,23H,12,14-15H2/b8-5+
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760 -35.5n/an/an/an/an/an/a30



Nagoya University School of Medicine



Assay Description
Protein kinase C, cAMP dependent protein kinase, cGMP dependent protein kinase and myosin light chain kinase activity were measure under conditions d...


Citation and Details
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Homo sapiens (Human))
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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1.60E+3n/an/an/an/an/an/an/an/a



Temple University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 316: 869-74 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Homo sapiens (Human))
BDBM86727
PNG
(1-(5-isoquinolinesulfonyl)-2-methylpiperazine.2HCl...)
Show SMILES CC1CN(CCN1)S(=O)(=O)c1cccc2cnccc12
Show InChI InChI=1S/C14H17N3O2S/c1-11-10-17(8-7-16-11)20(18,19)14-4-2-3-12-9-15-6-5-13(12)14/h2-6,9,11,16H,7-8,10H2,1H3
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5.80E+3n/an/an/an/an/an/an/an/a



Temple University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 316: 869-74 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210476
PNG
((2,5-difluorobenzyl)-{4-[7-dimethylaminomethyl-2-(...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2cc(F)ccc2F)n1
Show InChI InChI=1S/C27H23F3N6/c1-35(2)16-17-10-12-36-24(13-17)34-25(18-3-5-20(28)6-4-18)26(36)23-9-11-31-27(33-23)32-15-19-14-21(29)7-8-22(19)30/h3-14H,15-16H2,1-2H3,(H,31,32,33)
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n/an/a 0.0260n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182369
PNG
(4-(2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)H-...)
Show SMILES CN1CCC(CC1)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C23H23FN6/c1-29-11-7-15(8-12-29)17-9-13-30-20(14-17)28-21(16-2-4-18(24)5-3-16)22(30)19-6-10-26-23(25)27-19/h2-6,9-10,13-15H,7-8,11-12H2,1H3,(H2,25,26,27)
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n/an/a 0.0400n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against PKG


Bioorg Med Chem Lett 16: 2479-83 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182369
PNG
(4-(2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)H-...)
Show SMILES CN1CCC(CC1)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C23H23FN6/c1-29-11-7-15(8-12-29)17-9-13-30-20(14-17)28-21(16-2-4-18(24)5-3-16)22(30)19-6-10-26-23(25)27-19/h2-6,9-10,13-15H,7-8,11-12H2,1H3,(H2,25,26,27)
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n/an/a 0.0440n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella parasite-specific cGMP-dependent protein kinase


Bioorg Med Chem Lett 19: 1517-21 (2009)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265424
PNG
(2-{4-[3-(2-Aminopyrimidin-4-yl)-2-(4-fluorophenyl)...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(CCO)CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H25FN6O/c25-19-3-1-17(2-4-19)22-23(20-5-9-27-24(26)28-20)31-12-8-18(15-21(31)29-22)16-6-10-30(11-7-16)13-14-32/h1-5,8-9,12,15-16,32H,6-7,10-11,13-14H2,(H2,26,27,28)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182369
PNG
(4-(2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)H-...)
Show SMILES CN1CCC(CC1)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C23H23FN6/c1-29-11-7-15(8-12-29)17-9-13-30-20(14-17)28-21(16-2-4-18(24)5-3-16)22(30)19-6-10-26-23(25)27-19/h2-6,9-10,13-15H,7-8,11-12H2,1H3,(H2,25,26,27)
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n/an/a 0.0440n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182367
PNG
(4-(2-(4-fluorophenyl)-7-(piperidin-4-yl)H-imidazo[...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCNCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H21FN6/c23-17-3-1-15(2-4-17)20-21(18-7-11-26-22(24)27-18)29-12-8-16(13-19(29)28-20)14-5-9-25-10-6-14/h1-4,7-8,11-14,25H,5-6,9-10H2,(H2,24,26,27)
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n/an/a 0.0460n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50168170
PNG
(3-{4-[5-(4-Fluoro-phenyl)-4-pyridin-4-yl-1H-pyrrol...)
Show SMILES NCCCN1CCC(CC1)c1cc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C23H27FN4/c24-20-4-2-19(3-5-20)23-21(17-6-11-26-12-7-17)16-22(27-23)18-8-14-28(15-9-18)13-1-10-25/h2-7,11-12,16,18,27H,1,8-10,13-15,25H2
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n/an/a 0.0460n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibition of Eimeria tenella cGMP-dependent protein kinase


Bioorg Med Chem Lett 15: 3296-301 (2005)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182367
PNG
(4-(2-(4-fluorophenyl)-7-(piperidin-4-yl)H-imidazo[...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCNCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H21FN6/c23-17-3-1-15(2-4-17)20-21(18-7-11-26-22(24)27-18)29-12-8-16(13-19(29)28-20)14-5-9-25-10-6-14/h1-4,7-8,11-14,25H,5-6,9-10H2,(H2,24,26,27)
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n/an/a 0.0500n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against PKG


Bioorg Med Chem Lett 16: 2479-83 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50211814
PNG
(4-(2-(4-fluorophenyl)-7-((isopropylamino)methyl)H-...)
Show SMILES CC(C)NCc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N[C@@H](C)c2ccccc2)n1
Show InChI InChI=1S/C29H29FN6/c1-19(2)32-18-21-14-16-36-26(17-21)35-27(23-9-11-24(30)12-10-23)28(36)25-13-15-31-29(34-25)33-20(3)22-7-5-4-6-8-22/h4-17,19-20,32H,18H2,1-3H3,(H,31,33,34)/t20-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210490
PNG
((2-chlorobenzyl)-{4-[7-dimethylaminomethyl-2-(4-fl...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccccc2Cl)n1
Show InChI InChI=1S/C27H24ClFN6/c1-34(2)17-18-12-14-35-24(15-18)33-25(19-7-9-21(29)10-8-19)26(35)23-11-13-30-27(32-23)31-16-20-5-3-4-6-22(20)28/h3-15H,16-17H2,1-2H3,(H,30,31,32)
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n/an/a 0.0560n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210479
PNG
((2,6-difluorobenzyl)-{4-[7-dimethylaminomethyl-2-(...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2c(F)cccc2F)n1
Show InChI InChI=1S/C27H23F3N6/c1-35(2)16-17-11-13-36-24(14-17)34-25(18-6-8-19(28)9-7-18)26(36)23-10-12-31-27(33-23)32-15-20-21(29)4-3-5-22(20)30/h3-14H,15-16H2,1-2H3,(H,31,32,33)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210473
PNG
((3,4-difluorobenzyl)-{4-[7-dimethylaminomethyl-2-(...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccc(F)c(F)c2)n1
Show InChI InChI=1S/C27H23F3N6/c1-35(2)16-18-10-12-36-24(14-18)34-25(19-4-6-20(28)7-5-19)26(36)23-9-11-31-27(33-23)32-15-17-3-8-21(29)22(30)13-17/h3-14H,15-16H2,1-2H3,(H,31,32,33)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50211811
PNG
(4-(7-((dimethylamino)methyl)-2-(4-fluorophenyl)H-i...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C26H23FN6/c1-32(2)17-18-13-15-33-23(16-18)31-24(19-8-10-20(27)11-9-19)25(33)22-12-14-28-26(30-22)29-21-6-4-3-5-7-21/h3-16H,17H2,1-2H3,(H,28,29,30)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210495
PNG
(CHEMBL251184 | cyclopropylmethyl{4-[7-dimethylamin...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCC2CC2)n1
Show InChI InChI=1S/C24H25FN6/c1-30(2)15-17-10-12-31-21(13-17)29-22(18-5-7-19(25)8-6-18)23(31)20-9-11-26-24(28-20)27-14-16-3-4-16/h5-13,16H,3-4,14-15H2,1-2H3,(H,26,27,28)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265419
PNG
(4-[7-(1-Dimethylaminobutyl)-2-(4-fluorophenyl)imid...)
Show SMILES CCCC(N(C)C)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C23H25FN6/c1-4-5-19(29(2)3)16-11-13-30-20(14-16)28-21(15-6-8-17(24)9-7-15)22(30)18-10-12-26-23(25)27-18/h6-14,19H,4-5H2,1-3H3,(H2,25,26,27)
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n/an/a 0.0650n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265425
PNG
(2-{4-[3-(2-Aminopyrimidin-4-yl)-2-(4-fluorophenyl)...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(CCCO)CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C25H27FN6O/c26-20-4-2-18(3-5-20)23-24(21-6-10-28-25(27)29-21)32-14-9-19(16-22(32)30-23)17-7-12-31(13-8-17)11-1-15-33/h2-6,9-10,14,16-17,33H,1,7-8,11-13,15H2,(H2,27,28,29)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210517
PNG
(CHEMBL249527 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccc(F)cc2)n1
Show InChI InChI=1S/C27H24F2N6/c1-34(2)17-19-12-14-35-24(15-19)33-25(20-5-9-22(29)10-6-20)26(35)23-11-13-30-27(32-23)31-16-18-3-7-21(28)8-4-18/h3-15H,16-17H2,1-2H3,(H,30,31,32)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265397
PNG
(4-[7-(1-Dimethylaminoethyl)-2-(4-fluorophenyl)imid...)
Show SMILES CC(N(C)C)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C21H21FN6/c1-13(27(2)3)15-9-11-28-18(12-15)26-19(14-4-6-16(22)7-5-14)20(28)17-8-10-24-21(23)25-17/h4-13H,1-3H3,(H2,23,24,25)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265430
PNG
(4-[2-(4-Fluorophenyl)-7-(1-phenethylpiperidin-4-yl...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(CCc2ccccc2)CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C30H29FN6/c31-25-8-6-23(7-9-25)28-29(26-10-15-33-30(32)34-26)37-19-14-24(20-27(37)35-28)22-12-17-36(18-13-22)16-11-21-4-2-1-3-5-21/h1-10,14-15,19-20,22H,11-13,16-18H2,(H2,32,33,34)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50211805
PNG
(4-(7-(((3-(dimethylamino)propyl)(methyl)amino)meth...)
Show SMILES C[C@H](Nc1nccc(n1)-c1c(nc2cc(CN(C)CCCN(C)C)ccn12)-c1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C32H36FN7/c1-23(25-9-6-5-7-10-25)35-32-34-17-15-28(36-32)31-30(26-11-13-27(33)14-12-26)37-29-21-24(16-20-40(29)31)22-39(4)19-8-18-38(2)3/h5-7,9-17,20-21,23H,8,18-19,22H2,1-4H3,(H,34,35,36)/t23-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50374578
PNG
(CHEMBL401749)
Show SMILES Fc1ccc(cc1)-c1[nH]c(cc1-c1ccncc1)C1CCN(CC2CNCCN2)CC1
Show InChI InChI=1S/C25H30FN5/c26-21-3-1-20(2-4-21)25-23(18-5-9-27-10-6-18)15-24(30-25)19-7-13-31(14-8-19)17-22-16-28-11-12-29-22/h1-6,9-10,15,19,22,28-30H,7-8,11-14,16-17H2
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Bioorg Med Chem Lett 18: 2019-22 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210508
PNG
(CHEMBL250791 | cyclopropyl{4-[7-dimethylaminomethy...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NC2CC2)n1
Show InChI InChI=1S/C23H23FN6/c1-29(2)14-15-10-12-30-20(13-15)28-21(16-3-5-17(24)6-4-16)22(30)19-9-11-25-23(27-19)26-18-7-8-18/h3-6,9-13,18H,7-8,14H2,1-2H3,(H,25,26,27)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50374594
PNG
(CHEMBL444009)
Show SMILES Fc1ccc(cc1)-c1[nH]c(cc1-c1ccncc1)C1CCN(CCN2CCC2)CC1
Show InChI InChI=1S/C25H29FN4/c26-22-4-2-21(3-5-22)25-23(19-6-10-27-11-7-19)18-24(28-25)20-8-14-30(15-9-20)17-16-29-12-1-13-29/h2-7,10-11,18,20,28H,1,8-9,12-17H2
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Bioorg Med Chem Lett 18: 2019-22 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210494
PNG
(CHEMBL250601 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccccc2C)n1
Show InChI InChI=1S/C28H27FN6/c1-19-6-4-5-7-22(19)17-31-28-30-14-12-24(32-28)27-26(21-8-10-23(29)11-9-21)33-25-16-20(18-34(2)3)13-15-35(25)27/h4-16H,17-18H2,1-3H3,(H,30,31,32)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182359
PNG
(CHEMBL379059 | N-benzyl-4-(7-((dimethylamino)methy...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccccc2)n1
Show InChI InChI=1S/C27H25FN6/c1-33(2)18-20-13-15-34-24(16-20)32-25(21-8-10-22(28)11-9-21)26(34)23-12-14-29-27(31-23)30-17-19-6-4-3-5-7-19/h3-16H,17-18H2,1-2H3,(H,29,30,31)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182359
PNG
(CHEMBL379059 | N-benzyl-4-(7-((dimethylamino)methy...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccccc2)n1
Show InChI InChI=1S/C27H25FN6/c1-33(2)18-20-13-15-34-24(16-20)32-25(21-8-10-22(28)11-9-21)26(34)23-12-14-29-27(31-23)30-17-19-6-4-3-5-7-19/h3-16H,17-18H2,1-2H3,(H,29,30,31)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against PKG


Bioorg Med Chem Lett 16: 2479-83 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210489
PNG
(CHEMBL249526 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2cccc(C)c2)n1
Show InChI InChI=1S/C28H27FN6/c1-19-5-4-6-20(15-19)17-31-28-30-13-11-24(32-28)27-26(22-7-9-23(29)10-8-22)33-25-16-21(18-34(2)3)12-14-35(25)27/h4-16H,17-18H2,1-3H3,(H,30,31,32)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210493
PNG
(CHEMBL401102 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2ccccc2F)n1
Show InChI InChI=1S/C27H24F2N6/c1-34(2)17-18-12-14-35-24(15-18)33-25(19-7-9-21(28)10-8-19)26(35)23-11-13-30-27(32-23)31-16-20-5-3-4-6-22(20)29/h3-15H,16-17H2,1-2H3,(H,30,31,32)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210478
PNG
(CHEMBL249326 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NCc2cccc(F)c2)n1
Show InChI InChI=1S/C27H24F2N6/c1-34(2)17-19-11-13-35-24(15-19)33-25(20-6-8-21(28)9-7-20)26(35)23-10-12-30-27(32-23)31-16-18-4-3-5-22(29)14-18/h3-15H,16-17H2,1-2H3,(H,30,31,32)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265397
PNG
(4-[7-(1-Dimethylaminoethyl)-2-(4-fluorophenyl)imid...)
Show SMILES CC(N(C)C)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C21H21FN6/c1-13(27(2)3)15-9-11-28-18(12-15)26-19(14-4-6-16(22)7-5-14)20(28)17-8-10-24-21(23)25-17/h4-13H,1-3H3,(H2,23,24,25)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265427
PNG
(4-[7-(1-Cyclopropylmethylpiperidin-4-yl)-2-(4-fluo...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(CC2CC2)CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H27FN6/c27-21-5-3-19(4-6-21)24-25(22-7-11-29-26(28)30-22)33-14-10-20(15-23(33)31-24)18-8-12-32(13-9-18)16-17-1-2-17/h3-7,10-11,14-15,17-18H,1-2,8-9,12-13,16H2,(H2,28,29,30)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50195444
PNG
(2-(ethyl((2-(4-fluorophenyl)-3-(2-((S)-1-phenyleth...)
Show SMILES CCN(CCO)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(n1)[C@@H](C)c1ccccc1
Show InChI InChI=1S/C30H30FN5O/c1-3-35(17-18-37)20-22-14-16-36-27(19-22)34-28(24-9-11-25(31)12-10-24)29(36)26-13-15-32-30(33-26)21(2)23-7-5-4-6-8-23/h4-16,19,21,37H,3,17-18,20H2,1-2H3/t21-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella PKG


Bioorg Med Chem Lett 16: 5978-81 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210511
PNG
(4-[2-(2,4-difluorophenyl)-7-dimethylaminomethylimi...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1F)-c1ccnc(N)n1
Show InChI InChI=1S/C20H18F2N6/c1-27(2)11-12-6-8-28-17(9-12)26-18(14-4-3-13(21)10-15(14)22)19(28)16-5-7-24-20(23)25-16/h3-10H,11H2,1-2H3,(H2,23,24,25)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210500
PNG
(CHEMBL251589 | {4-[7-dimethylaminomethyl-2-(4-fluo...)
Show SMILES CCCCCNc1nccc(n1)-c1c(nc2cc(CN(C)C)ccn12)-c1ccc(F)cc1
Show InChI InChI=1S/C25H29FN6/c1-4-5-6-13-27-25-28-14-11-21(29-25)24-23(19-7-9-20(26)10-8-19)30-22-16-18(17-31(2)3)12-15-32(22)24/h7-12,14-16H,4-6,13,17H2,1-3H3,(H,27,28,29)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50211820
PNG
(4-(7-(((2-(azetidin-1-yl)ethyl)(methyl)amino)methy...)
Show SMILES C[C@H](Nc1nccc(n1)-c1c(nc2cc(CN(C)CCN3CCC3)ccn12)-c1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C32H34FN7/c1-23(25-7-4-3-5-8-25)35-32-34-15-13-28(36-32)31-30(26-9-11-27(33)12-10-26)37-29-21-24(14-18-40(29)31)22-38(2)19-20-39-16-6-17-39/h3-5,7-15,18,21,23H,6,16-17,19-20,22H2,1-2H3,(H,34,35,36)/t23-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50248496
PNG
(2-(4-(2-(4-fluorophenyl)-3-(pyridin-4-yl)-1H-indol...)
Show SMILES OCCN1CCC(CC1)c1ccc2c(c([nH]c2c1)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C26H26FN3O/c27-22-4-1-20(2-5-22)26-25(19-7-11-28-12-8-19)23-6-3-21(17-24(23)29-26)18-9-13-30(14-10-18)15-16-31/h1-8,11-12,17-18,29,31H,9-10,13-16H2
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella parasite-specific cGMP-dependent protein kinase


Bioorg Med Chem Lett 19: 1517-21 (2009)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50210514
PNG
(CHEMBL399257 | cyclopentyl{4-[7-dimethylaminomethy...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(NC2CCCC2)n1
Show InChI InChI=1S/C25H27FN6/c1-31(2)16-17-12-14-32-22(15-17)30-23(18-7-9-19(26)10-8-18)24(32)21-11-13-27-25(29-21)28-20-5-3-4-6-20/h7-15,20H,3-6,16H2,1-2H3,(H,27,28,29)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase by Ten_K assay


Eur J Med Chem 42: 1334-57 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50195435
PNG
(2-(((2-(4-fluorophenyl)-3-(2-((S)-1-phenylethyl)py...)
Show SMILES C[C@@H](c1ccccc1)c1nccc(n1)-c1c(nc2cc(CN(C)CCO)ccn12)-c1ccc(F)cc1
Show InChI InChI=1S/C29H28FN5O/c1-20(22-6-4-3-5-7-22)29-31-14-12-25(32-29)28-27(23-8-10-24(30)11-9-23)33-26-18-21(13-15-35(26)28)19-34(2)16-17-36/h3-15,18,20,36H,16-17,19H2,1-2H3/t20-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella PKG


Bioorg Med Chem Lett 16: 5978-81 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182362
PNG
(4-(7-((dimethylamino)methyl)-2-(4-fluorophenyl)H-i...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C20H19FN6/c1-26(2)12-13-8-10-27-17(11-13)25-18(14-3-5-15(21)6-4-14)19(27)16-7-9-23-20(22)24-16/h3-11H,12H2,1-2H3,(H2,22,23,24)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against PKG


Bioorg Med Chem Lett 16: 2479-83 (2006)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50182362
PNG
(4-(7-((dimethylamino)methyl)-2-(4-fluorophenyl)H-i...)
Show SMILES CN(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C20H19FN6/c1-26(2)12-13-8-10-27-17(11-13)25-18(14-3-5-15(21)6-4-14)19(27)16-7-9-23-20(22)24-16/h3-11H,12H2,1-2H3,(H2,22,23,24)
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SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265421
PNG
(4-[7-(1-Dimethylamino-1-methyl-ethyl)-2-(4-fluorop...)
Show SMILES CN(C)C(C)(C)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C22H23FN6/c1-22(2,28(3)4)15-10-12-29-18(13-15)27-19(14-5-7-16(23)8-6-14)20(29)17-9-11-25-21(24)26-17/h5-13H,1-4H3,(H2,24,25,26)
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n/an/a 0.110n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50211812
PNG
(4-(2-(4-fluorophenyl)-7-((isopropyl(methyl)amino)m...)
Show SMILES CC(C)N(C)Cc1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N[C@@H](C)c2ccccc2)n1
Show InChI InChI=1S/C30H31FN6/c1-20(2)36(4)19-22-15-17-37-27(18-22)35-28(24-10-12-25(31)13-11-24)29(37)26-14-16-32-30(34-26)33-21(3)23-8-6-5-7-9-23/h5-18,20-21H,19H2,1-4H3,(H,32,33,34)/t21-/m0/s1
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n/an/a 0.110n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Et-PKG


Bioorg Med Chem Lett 17: 3558-61 (2007)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265402
PNG
(4-[7-[1-(3,3-Dimethylbutyl)piperidin-4-yl)-2-(4-fl...)
Show SMILES CC(C)(C)CCN1CCC(CC1)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C28H33FN6/c1-28(2,3)12-17-34-14-9-19(10-15-34)21-11-16-35-24(18-21)33-25(20-4-6-22(29)7-5-20)26(35)23-8-13-31-27(30)32-23/h4-8,11,13,16,18-19H,9-10,12,14-15,17H2,1-3H3,(H2,30,31,32)
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n/an/a 0.110n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265429
PNG
(4-[7-(1-Benzylpiperidin-4-yl)-2-(4-fluorophenyl)-i...)
Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(Cc2ccccc2)CC1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H27FN6/c30-24-8-6-22(7-9-24)27-28(25-10-14-32-29(31)33-25)36-17-13-23(18-26(36)34-27)21-11-15-35(16-12-21)19-20-4-2-1-3-5-20/h1-10,13-14,17-18,21H,11-12,15-16,19H2,(H2,31,32,33)
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n/an/a 0.110n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50265404
PNG
(4-(7-(1-ethylpiperidin-4-yl)-2-(4-fluorophenyl)imi...)
Show SMILES CCN1CCC(CC1)c1ccn2c(c(nc2c1)-c1ccc(F)cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C24H25FN6/c1-2-30-12-8-16(9-13-30)18-10-14-31-21(15-18)29-22(17-3-5-19(25)6-4-17)23(31)20-7-11-27-24(26)28-20/h3-7,10-11,14-16H,2,8-9,12-13H2,1H3,(H2,26,27,28)
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n/an/a 0.110n/an/an/an/an/an/a



SCYNEXIS, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Eimeria tenella cGMP-dependent protein kinase


Eur J Med Chem 43: 1123-51 (2008)

More data for this
Ligand-Target Pair
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