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Compile Data Set for Download or QSAR

Found 20 hits Enz. Inhib. hit(s) with all data for entry = 50000337   
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-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 0.0280n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 0.0880n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 660n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE7A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 810n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A2 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 3.46E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE7A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cAMP-specific and IBMX-insensitive 3',5'-cyclic phosphodiesterase 8A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 3.56E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE8A1 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 4.03E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A2 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 4.61E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 6.21E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a 7.40E+3n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE1A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 1.39E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cAMP-specific and IBMX-insensitive 3',5'-cyclic phosphodiesterase 8A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE8A1 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a 2.56E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE1A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE2A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE9A2 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A


(Homo sapiens (Human))
BDBM50246909
PNG
(CHEMBL4075951)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCS[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C31H31Cl2F2N3O8S2/c1-36(2)28(39)20-4-3-5-21(12-20)48(42,43)38-10-11-47-29(38)30(40)45-26(14-22-23(32)15-37(41)16-24(22)33)19-8-9-25(46-31(34)35)27(13-19)44-17-18-6-7-18/h3-5,8-9,12-13,15-16,18,26,29,31H,6-7,10-11,14,17H2,1-2H3/t26-,29-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A4 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE2A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE9A2 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3A expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair
Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A


(Homo sapiens (Human))
BDBM50246908
PNG
(CHEMBL4093768)
Show SMILES CN(C)C(=O)c1cccc(c1)S(=O)(=O)N1CCC[C@H]1C(=O)O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c(OCC2CC2)c1 |r|
Show InChI InChI=1S/C32H33Cl2F2N3O8S/c1-37(2)30(40)21-5-3-6-22(13-21)48(43,44)39-12-4-7-26(39)31(41)46-28(15-23-24(33)16-38(42)17-25(23)34)20-10-11-27(47-32(35)36)29(14-20)45-18-19-8-9-19/h3,5-6,10-11,13-14,16-17,19,26,28,32H,4,7-9,12,15,18H2,1-2H3/t26-,28-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chiesi Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A4 expressed insect sf9 cells by radiometric assay


J Med Chem 60: 10026-10046 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01044
BindingDB Entry DOI: 10.7270/Q25H7JN4
More data for this
Ligand-Target Pair