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Compile Data Set for Download or QSAR

Found 18 hits of ph data with Target = 'cGMP-dependent 3',5'-cyclic phosphodiesterase'   
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 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119835
PNG
(US8691986, 1)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CCN(CC1)c1ccc2ccc(Cl)cc2n1
Show InChI InChI=1S/C26H23ClFN5O/c1-29-26(34)20-6-3-18(14-21(20)28)25-24(30-10-11-31-25)17-8-12-33(13-9-17)23-7-4-16-2-5-19(27)15-22(16)32-23/h2-7,10-11,14-15,17H,8-9,12-13H2,1H3,(H,29,34)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119850
PNG
(US8691986, 17 | US9718803, 5.19)
Show SMILES CNC(=O)c1cccc(c1)-c1nccnc1C1CN(C1)c1ccc2ccccc2n1
Show InChI InChI=1S/C24H21N5O/c1-25-24(30)18-7-4-6-17(13-18)22-23(27-12-11-26-22)19-14-29(15-19)21-10-9-16-5-2-3-8-20(16)28-21/h2-13,19H,14-15H2,1H3,(H,25,30)
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n/an/a 2.16E+3n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119836
PNG
(US8691986, 2)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CCN(CC1)c1ccc2ccc(F)cc2n1
Show InChI InChI=1S/C26H23F2N5O/c1-29-26(34)20-6-3-18(14-21(20)28)25-24(30-10-11-31-25)17-8-12-33(13-9-17)23-7-4-16-2-5-19(27)15-22(16)32-23/h2-7,10-11,14-15,17H,8-9,12-13H2,1H3,(H,29,34)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119837
PNG
(US8691986, 3)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CCN(CC1)c1ccc2ccccc2n1
Show InChI InChI=1S/C26H24FN5O/c1-28-26(33)20-8-6-19(16-21(20)27)25-24(29-12-13-30-25)18-10-14-32(15-11-18)23-9-7-17-4-2-3-5-22(17)31-23/h2-9,12-13,16,18H,10-11,14-15H2,1H3,(H,28,33)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119838
PNG
(US8691986, 4)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CCN(CC1)c1ccc2cc(F)ccc2n1
Show InChI InChI=1S/C26H23F2N5O/c1-29-26(34)20-5-2-18(15-21(20)28)25-24(30-10-11-31-25)16-8-12-33(13-9-16)23-7-3-17-14-19(27)4-6-22(17)32-23/h2-7,10-11,14-16H,8-9,12-13H2,1H3,(H,29,34)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119839
PNG
(US8691986, 5)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CCN(CC1)c1ccc2cccc(F)c2n1
Show InChI InChI=1S/C26H23F2N5O/c1-29-26(34)19-7-5-18(15-21(19)28)25-24(30-11-12-31-25)17-9-13-33(14-10-17)22-8-6-16-3-2-4-20(27)23(16)32-22/h2-8,11-12,15,17H,9-10,13-14H2,1H3,(H,29,34)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119840
PNG
(US8691986, 6)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ncc2ccccc2n1
Show InChI InChI=1S/C23H19FN6O/c1-25-22(31)17-7-6-14(10-18(17)24)20-21(27-9-8-26-20)16-12-30(13-16)23-28-11-15-4-2-3-5-19(15)29-23/h2-11,16H,12-13H2,1H3,(H,25,31)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119841
PNG
(US8691986, 7)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ccc2ccccc2n1
Show InChI InChI=1S/C24H20FN5O/c1-26-24(31)18-8-6-16(12-19(18)25)22-23(28-11-10-27-22)17-13-30(14-17)21-9-7-15-4-2-3-5-20(15)29-21/h2-12,17H,13-14H2,1H3,(H,26,31)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119842
PNG
(US8691986, 8)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ccc2ccc(F)cc2n1
Show InChI InChI=1S/C24H19F2N5O/c1-27-24(32)18-6-3-15(10-19(18)26)22-23(29-9-8-28-22)16-12-31(13-16)21-7-4-14-2-5-17(25)11-20(14)30-21/h2-11,16H,12-13H2,1H3,(H,27,32)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119843
PNG
(US8691986, 9)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ncc2ccc(F)cc2n1
Show InChI InChI=1S/C23H18F2N6O/c1-26-22(32)17-5-3-13(8-18(17)25)20-21(28-7-6-27-20)15-11-31(12-15)23-29-10-14-2-4-16(24)9-19(14)30-23/h2-10,15H,11-12H2,1H3,(H,26,32)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119844
PNG
(US8691986, 10)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ncc2ccc(Cl)cc2n1
Show InChI InChI=1S/C23H18ClFN6O/c1-26-22(32)17-5-3-13(8-18(17)25)20-21(28-7-6-27-20)15-11-31(12-15)23-29-10-14-2-4-16(24)9-19(14)30-23/h2-10,15H,11-12H2,1H3,(H,26,32)
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n/an/a 7.38E+3n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119845
PNG
(US8691986, 11)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ncc2cc(F)ccc2n1
Show InChI InChI=1S/C23H18F2N6O/c1-26-22(32)17-4-2-13(9-18(17)25)20-21(28-7-6-27-20)15-11-31(12-15)23-29-10-14-8-16(24)3-5-19(14)30-23/h2-10,15H,11-12H2,1H3,(H,26,32)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119846
PNG
(US8691986, 12)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ncc2cc(F)c(Cl)cc2n1
Show InChI InChI=1S/C23H17ClF2N6O/c1-27-22(33)15-3-2-12(6-17(15)25)20-21(29-5-4-28-20)14-10-32(11-14)23-30-9-13-7-18(26)16(24)8-19(13)31-23/h2-9,14H,10-11H2,1H3,(H,27,33)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119847
PNG
(US8691986, 13)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ccc2cc(F)ccc2n1
Show InChI InChI=1S/C24H19F2N5O/c1-27-24(32)18-5-2-15(11-19(18)26)22-23(29-9-8-28-22)16-12-31(13-16)21-7-3-14-10-17(25)4-6-20(14)30-21/h2-11,16H,12-13H2,1H3,(H,27,32)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119848
PNG
(US8691986, 14)
Show SMILES CNC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ccc2ncc(Cl)cc2n1
Show InChI InChI=1S/C23H18ClFN6O/c1-26-23(32)16-3-2-13(8-17(16)25)21-22(28-7-6-27-21)14-11-31(12-14)20-5-4-18-19(30-20)9-15(24)10-29-18/h2-10,14H,11-12H2,1H3,(H,26,32)
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Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119851
PNG
(US8691986, 15 | US9718803, 30.2)
Show SMILES NC(=O)c1ccc(cc1)-c1nccnc1C1CN(C1)c1ccc2ccccc2n1
Show InChI InChI=1S/C23H19N5O/c24-23(29)17-7-5-16(6-8-17)21-22(26-12-11-25-21)18-13-28(14-18)20-10-9-15-3-1-2-4-19(15)27-20/h1-12,18H,13-14H2,(H2,24,29)
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n/an/a 1.00E+4n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM119849
PNG
(US8691986, 16 | US9718803, 30.4)
Show SMILES NC(=O)c1ccc(cc1F)-c1nccnc1C1CN(C1)c1ccc2ccccc2n1
Show InChI InChI=1S/C23H18FN5O/c24-18-11-15(5-7-17(18)23(25)30)21-22(27-10-9-26-21)16-12-29(13-16)20-8-6-14-3-1-2-4-19(14)28-20/h1-11,16H,12-13H2,(H2,25,30)
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n/an/a 3.30E+3n/an/an/an/a7.225



Amgen Inc.

US Patent


Assay Description
IMAP TR-FRET progressive binding system, FAM-cAMP substrate were from Molecular Devices (Sunnyvale, Calif.). The PDE IMAP assay was conducted in a 3...


US Patent US8691986 (2014)


BindingDB Entry DOI: 10.7270/Q26T0K9T
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM22926
PNG
(3-(6-amino-9H-purin-9-yl)nonan-2-ol | EHNA | Eryth...)
Show SMILES CCCCCCC(C(C)O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C14H23N5O/c1-3-4-5-6-7-11(10(2)20)19-9-18-12-13(15)16-8-17-14(12)19/h8-11,20H,3-7H2,1-2H3,(H2,15,16,17)
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Article
PubMed
n/an/a 800n/an/an/an/a7.524



University of North Carolina



Assay Description
Enzymatic activities were assayed using [3H] cAMP and [3H]cGMP as substrate.


J Biol Chem 287: 11788-97 (2012)


Article DOI: 10.1074/jbc.M111.326777
BindingDB Entry DOI: 10.7270/Q2K9364D
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)