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PubMed code 21189023

Compile data set for download or QSAR
Found 66 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a 3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335830
PNG
((6R,12aS)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21+/m0/s1
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n/an/a 10n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a 11n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335846
PNG
((5R,11aR)5-(3,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-14-13-6-4-5-7-17(13)26-19(14)20(27(18)22(28)30)12-8-9-15(24)16(25)10-12/h4-10,20,26,29H,11H2,1-3H3/t20-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335826
PNG
((6R,12aS)6-(2,4-Dichlorophenyl)-2-methyl-2,3,6,7,1...)
Show SMILES CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-25-10-18(27)26-17(21(25)28)9-14-12-4-2-3-5-16(12)24-19(14)20(26)13-7-6-11(22)8-15(13)23/h2-8,17,20,24H,9-10H2,1H3/t17-,20+/m0/s1
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n/an/a 50n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a 50n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335823
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-methyl-2,3,6,7,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-25-10-18(27)26-17(21(25)28)9-14-12-4-2-3-5-16(12)24-19(14)20(26)13-7-6-11(22)8-15(13)23/h2-8,17,20,24H,9-10H2,1H3/t17-,20-/m1/s1
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n/an/a 50n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335845
PNG
((5R,11aS)5-(2,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-15-13-6-4-5-7-17(13)26-19(15)20(27(18)22(28)30)14-9-8-12(24)10-16(14)25/h4-10,20,26,29H,11H2,1-3H3/t20-/m1/s1
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n/an/a 70n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335855
PNG
((5S,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m0/s1
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n/an/a 90n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a 104n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335857
PNG
((5R,11aR)5-(3,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-13-12-5-3-4-6-16(12)24-18(13)19(26(17)21(25)28)11-7-8-14(22)15(23)9-11/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335838
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-tert-butyl-2,3,6...)
Show SMILES CC(C)(C)N1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-24(2,3)28-12-20(30)29-19(23(28)31)11-16-14-6-4-5-7-18(14)27-21(16)22(29)15-9-8-13(25)10-17(15)26/h4-10,19,22,27H,11-12H2,1-3H3/t19-,22-/m1/s1
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n/an/a 190n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335841
PNG
((6R,12aS)6-(2,4-Dichlorophenyl)-2-tert-butyl-2,3,6...)
Show SMILES CC(C)(C)N1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-24(2,3)28-12-20(30)29-19(23(28)31)11-16-14-6-4-5-7-18(14)27-21(16)22(29)15-9-8-13(25)10-17(15)26/h4-10,19,22,27H,11-12H2,1-3H3/t19-,22+/m0/s1
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n/an/a 260n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335828
PNG
((6S,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21+/m1/s1
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n/an/a 260n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335834
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-butyl-2,3,6,7,12...)
Show SMILES CCCCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-2-3-10-28-13-21(30)29-20(24(28)31)12-17-15-6-4-5-7-19(15)27-22(17)23(29)16-9-8-14(25)11-18(16)26/h4-9,11,20,23,27H,2-3,10,12-13H2,1H3/t20-,23-/m1/s1
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n/an/a 270n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335837
PNG
((6R,12aS)6-(2,4-Dichlorophenyl)-2-butyl-2,3,6,7,12...)
Show SMILES CCCCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-2-3-10-28-13-21(30)29-20(24(28)31)12-17-15-6-4-5-7-19(15)27-22(17)23(29)16-9-8-14(25)11-18(16)26/h4-9,11,20,23,27H,2-3,10,12-13H2,1H3/t20-,23+/m0/s1
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n/an/a 290n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a 300n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335857
PNG
((5R,11aR)5-(3,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-13-12-5-3-4-6-16(12)24-18(13)19(26(17)21(25)28)11-7-8-14(22)15(23)9-11/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 300n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 310n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335851
PNG
((1S,3S)Methyl 1-(2,4-Dichlorophenyl)-2-(2-chloroac...)
Show SMILES COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](N1C(=O)CCl)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H17Cl3N2O3/c1-29-21(28)17-9-14-12-4-2-3-5-16(12)25-19(14)20(26(17)18(27)10-22)13-7-6-11(23)8-15(13)24/h2-8,17,20,25H,9-10H2,1H3/t17-,20-/m0/s1
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n/an/a 380n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335853
PNG
((1R,3S)Methyl-1-(2,4-Dichlorophenyl)-2,3,4,9-tetra...)
Show SMILES COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C19H16Cl2N2O2/c1-25-19(24)16-9-13-11-4-2-3-5-15(11)22-18(13)17(23-16)12-7-6-10(20)8-14(12)21/h2-8,16-17,22-23H,9H2,1H3/t16-,17+/m0/s1
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n/an/a 570n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335845
PNG
((5R,11aS)5-(2,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-15-13-6-4-5-7-17(13)26-19(15)20(27(18)22(28)30)14-9-8-12(24)10-16(14)25/h4-10,20,26,29H,11H2,1-3H3/t20-/m1/s1
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n/an/a 590n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335822
PNG
((1S,3S)Methyl 1-(2,6-Dichlorophenyl)-2-(2-chloroac...)
Show SMILES COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](N1C(=O)CCl)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C21H17Cl3N2O3/c1-29-21(28)16-9-12-11-5-2-3-8-15(11)25-19(12)20(26(16)17(27)10-22)18-13(23)6-4-7-14(18)24/h2-8,16,20,25H,9-10H2,1H3/t16-,20-/m0/s1
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n/an/a 730n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335825
PNG
((6S,12aS)6-(2,4-Dichlorophenyl)-2-methyl-2,3,6,7,1...)
Show SMILES CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-25-10-18(27)26-17(21(25)28)9-14-12-4-2-3-5-16(12)24-19(14)20(26)13-7-6-11(22)8-15(13)23/h2-8,17,20,24H,9-10H2,1H3/t17-,20-/m0/s1
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n/an/a 850n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335855
PNG
((5S,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m0/s1
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n/an/a 850n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335829
PNG
((6S,12aS)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m0/s1
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n/an/a 990n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335835
PNG
((6S,12aR)6-(2,4-Dichlorophenyl)-2-butyl-2,3,6,7,12...)
Show SMILES CCCCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-2-3-10-28-13-21(30)29-20(24(28)31)12-17-15-6-4-5-7-19(15)27-22(17)23(29)16-9-8-14(25)11-18(16)26/h4-9,11,20,23,27H,2-3,10,12-13H2,1H3/t20-,23+/m1/s1
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n/an/a 1.11E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335824
PNG
((6S,12aR)6-(2,4-Dichlorophenyl)-2-methyl-2,3,6,7,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-25-10-18(27)26-17(21(25)28)9-14-12-4-2-3-5-16(12)24-19(14)20(26)13-7-6-11(22)8-15(13)23/h2-8,17,20,24H,9-10H2,1H3/t17-,20+/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335839
PNG
((6S,12aR)6-(2,4-Dichlorophenyl)-2-tert-butyl-2,3,6...)
Show SMILES CC(C)(C)N1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-24(2,3)28-12-20(30)29-19(23(28)31)11-16-14-6-4-5-7-18(14)27-21(16)22(29)15-9-8-13(25)10-17(15)26/h4-10,19,22,27H,11-12H2,1-3H3/t19-,22+/m1/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335842
PNG
((6R,12aS)6-(3,4-Dichlorophenyl)-2-tert-butyl-2,3,6...)
Show SMILES CC(C)(C)N1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)c(Cl)c2)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-24(2,3)28-12-20(30)29-19(23(28)31)11-15-14-6-4-5-7-18(14)27-21(15)22(29)13-8-9-16(25)17(26)10-13/h4-10,19,22,27H,11-12H2,1-3H3/t19-,22+/m0/s1
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n/an/a 1.27E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335831
PNG
((6R,12aR)6-(3,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)c(Cl)c2)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-14-13-5-3-4-6-17(13)25-20(14)21(27)12-7-8-15(23)16(24)9-12/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a 1.34E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335840
PNG
((6S,12aS)6-(2,4-Dichlorophenyl)-2-tert-butyl-2,3,6...)
Show SMILES CC(C)(C)N1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-24(2,3)28-12-20(30)29-19(23(28)31)11-16-14-6-4-5-7-18(14)27-21(16)22(29)15-9-8-13(25)10-17(15)26/h4-10,19,22,27H,11-12H2,1-3H3/t19-,22-/m0/s1
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n/an/a 1.35E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335862
PNG
((5S,11aR)5-(2,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-15-13-6-4-5-7-17(13)26-19(15)20(27(18)22(28)30)14-9-8-12(24)10-16(14)25/h4-10,20,26,29H,11H2,1-3H3/t20-/m0/s1
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n/an/a 1.48E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335854
PNG
((1R,3R)Methyl-1-(3,4-dichlorophenyl)-2,3,4,9-tetra...)
Show SMILES COC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](N1)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H16Cl2N2O2/c1-25-19(24)16-9-12-11-4-2-3-5-15(11)22-18(12)17(23-16)10-6-7-13(20)14(21)8-10/h2-8,16-17,22-23H,9H2,1H3/t16-,17-/m1/s1
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n/an/a 1.61E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335846
PNG
((5R,11aR)5-(3,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-14-13-6-4-5-7-17(13)26-19(14)20(27(18)22(28)30)12-8-9-15(24)16(25)10-12/h4-10,20,26,29H,11H2,1-3H3/t20-/m1/s1
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n/an/a 1.87E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335833
PNG
((6R,12aS)6-(3,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)c(Cl)c2)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-14-13-5-3-4-6-17(13)25-20(14)21(27)12-7-8-15(23)16(24)9-12/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21+/m0/s1
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n/an/a 2.04E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335850
PNG
((1R,3R)Methyl 1-(2,4-Dichlorophenyl)-2-(2-chloroac...)
Show SMILES COC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](N1C(=O)CCl)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H17Cl3N2O3/c1-29-21(28)17-9-14-12-4-2-3-5-16(12)25-19(14)20(26(17)18(27)10-22)13-7-6-11(23)8-15(13)24/h2-8,17,20,25H,9-10H2,1H3/t17-,20-/m1/s1
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n/an/a 2.30E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335847
PNG
((5S,11aR)5-(3,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-14-13-6-4-5-7-17(13)26-19(14)20(27(18)22(28)30)12-8-9-15(24)16(25)10-12/h4-10,20,26,29H,11H2,1-3H3/t20-/m0/s1
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n/an/a 2.31E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335858
PNG
((5S,11aR)5-(3,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-13-12-5-3-4-6-16(12)24-18(13)19(26(17)21(25)28)11-7-8-14(22)15(23)9-11/h3-9,19,24,27H,2,10H2,1H3/t19-/m0/s1
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n/an/a 2.86E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335832
PNG
((6S,12aS)6-(3,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)c(Cl)c2)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-14-13-5-3-4-6-17(13)25-20(14)21(27)12-7-8-15(23)16(24)9-12/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m0/s1
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n/an/a 3.30E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 3.60E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335862
PNG
((5S,11aR)5-(2,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-15-13-6-4-5-7-17(13)26-19(15)20(27(18)22(28)30)14-9-8-12(24)10-16(14)25/h4-10,20,26,29H,11H2,1-3H3/t20-/m0/s1
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n/an/a 4.14E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335836
PNG
((6S,12aS)6-(2,4-Dichlorophenyl)-2-butyl-2,3,6,7,12...)
Show SMILES CCCCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C24H23Cl2N3O2/c1-2-3-10-28-13-21(30)29-20(24(28)31)12-17-15-6-4-5-7-19(15)27-22(17)23(29)16-9-8-14(25)11-18(16)26/h4-9,11,20,23,27H,2-3,10,12-13H2,1H3/t20-,23-/m0/s1
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n/an/a 4.46E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335847
PNG
((5S,11aR)5-(3,4-Dichlorophenyl)-2-tert-butyl-5,6,1...)
Show SMILES CC(C)(C)n1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C23H21Cl2N3O2/c1-23(2,3)28-21(29)18-11-14-13-6-4-5-7-17(13)26-19(14)20(27(18)22(28)30)12-8-9-15(24)16(25)10-12/h4-10,20,26,29H,11H2,1-3H3/t20-/m0/s1
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n/an/a 6.38E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335852
PNG
((1R,3R)Methyl-1-(2,4-dichlorophenyl)-2,3,4,9-tetra...)
Show SMILES COC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](N1)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C19H16Cl2N2O2/c1-25-19(24)16-9-13-11-4-2-3-5-15(11)22-18(13)17(23-16)12-7-6-10(20)8-14(12)21/h2-8,16-17,22-23H,9H2,1H3/t16-,17-/m1/s1
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n/an/a 7.20E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50335858
PNG
((5S,11aR)5-(3,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@H](c3ccc(Cl)c(Cl)c3)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-13-12-5-3-4-6-16(12)24-18(13)19(26(17)21(25)28)11-7-8-14(22)15(23)9-11/h3-9,19,24,27H,2,10H2,1H3/t19-/m0/s1
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n/an/a 8.75E+3n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE5 after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
Phosphodiesterase 11A (PDE11A)


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE11A-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a 3.40E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335843
PNG
((5R,11aR)5-(2,4-Dichlorophenyl)-2-ethyl-5,6,11,11a...)
Show SMILES CCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3ccc(Cl)cc3Cl)n2c1=O
Show InChI InChI=1S/C21H17Cl2N3O2/c1-2-25-20(27)17-10-14-12-5-3-4-6-16(12)24-18(14)19(26(17)21(25)28)13-8-7-11(22)9-15(13)23/h3-9,19,24,27H,2,10H2,1H3/t19-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM50335827
PNG
((6R,12aR)6-(2,4-Dichlorophenyl)-2-ethyl-2,3,6,7,12...)
Show SMILES CCN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc(Cl)cc2Cl)C1=O
Show InChI InChI=1S/C22H19Cl2N3O2/c1-2-26-11-19(28)27-18(22(26)29)10-15-13-5-3-4-6-17(13)25-20(15)21(27)14-8-7-12(23)9-16(14)24/h3-9,18,21,25H,2,10-11H2,1H3/t18-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase B


(Homo sapiens (human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE3B-mediated hydrolysis of cGMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM14777
PNG
((2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,1...)
Show SMILES CN1CC(=O)N2[C@H](Cc3c([nH]c4ccccc34)[C@H]2c2ccc3OCOc3c2)C1=O
Show InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE4B-mediated hydrolysis of cAMP after 30 mins by fluorescence polarization assay


J Med Chem 54: 495-509 (2011)


Article DOI: 10.1021/jm100842v
BindingDB Entry DOI: 10.7270/Q2RR1ZHQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%