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Compile Data Set for Download or QSAR

Found 38 hits Enz. Inhib. hit(s) with Target = 'Phosphodiesterase 2A' AND taxid = 10116   
Target
(Institution)
LigandTarget
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
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50146545
PNG
(2-[6-(3,4-Dimethoxy-benzylamino)-7-ethyl-7H-purin-...)
Show SMILES CCOC(=O)c1sc(Nc2nc(NCc3ccc(OC)c(OC)c3)c3n(CC)cnc3n2)nc1OC
Show InChI InChI=1S/C23H27N7O5S/c1-6-30-12-25-19-16(30)18(24-11-13-8-9-14(32-3)15(10-13)33-4)26-22(27-19)29-23-28-20(34-5)17(36-23)21(31)35-7-2/h8-10,12H,6-7,11H2,1-5H3,(H2,24,26,27,28,29)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033306
PNG
(Benzyl-(6-nitro-2-pyridin-3-yl-quinazolin-4-yl)-am...)
Show SMILES [O-][N+](=O)c1ccc2nc(nc(NCc3ccccc3)c2c1)-c1cccnc1
Show InChI InChI=1S/C20H15N5O2/c26-25(27)16-8-9-18-17(11-16)20(22-12-14-5-2-1-3-6-14)24-19(23-18)15-7-4-10-21-13-15/h1-11,13H,12H2,(H,22,23,24)
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n/an/a>3.00E+3n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033293
PNG
(Benzyl-(2-imidazol-1-yl-6-methoxy-quinazolin-4-yl)...)
Show SMILES COc1ccc2nc(nc(NCc3ccccc3)c2c1)-n1ccnc1
Show InChI InChI=1S/C19H17N5O/c1-25-15-7-8-17-16(11-15)18(21-12-14-5-3-2-4-6-14)23-19(22-17)24-10-9-20-13-24/h2-11,13H,12H2,1H3,(H,21,22,23)
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n/an/a>3.00E+3n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033312
PNG
(Benzyl-(6-chloro-2-imidazol-1-yl-quinazolin-4-yl)-...)
Show SMILES Clc1ccc2nc(nc(NCc3ccccc3)c2c1)-n1ccnc1
Show InChI InChI=1S/C18H14ClN5/c19-14-6-7-16-15(10-14)17(21-11-13-4-2-1-3-5-13)23-18(22-16)24-9-8-20-12-24/h1-10,12H,11H2,(H,21,22,23)
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n/an/a>3.00E+3n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM15297
PNG
(CHEMBL34431 | Cilostamide | N-Cyclohexyl-N-methyl-...)
Show SMILES CN(C1CCCCC1)C(=O)CCCOc1ccc2[nH]c(=O)ccc2c1
Show InChI InChI=1S/C20H26N2O3/c1-22(16-6-3-2-4-7-16)20(24)8-5-13-25-17-10-11-18-15(14-17)9-12-19(23)21-18/h9-12,14,16H,2-8,13H2,1H3,(H,21,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM14390
PNG
(5-[2-ethoxy-5-(4-methyl-1-piperazinylsulfonyl)phen...)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(C)CC1
Show InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM14361
PNG
((R,S)-Rolipram | 4-(3-cyclopentyloxy-4-methoxy-phe...)
Show SMILES COc1ccc(cc1OC1CCCC1)C1CNC(=O)C1
Show InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM14769
PNG
(6-(3,4-Dimethoxy-phenyl)-4,5-dimethyl-4,5-dihydro-...)
Show SMILES COc1cc(ccc1OC(F)F)-c1ccc(=O)[nH]n1
Show InChI InChI=1S/C12H10F2N2O3/c1-18-10-6-7(2-4-9(10)19-12(13)14)8-3-5-11(17)16-15-8/h2-6,12H,1H3,(H,16,17)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50421642
PNG
(CHEMBL516604)
Show SMILES COc1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1
Show InChI InChI=1S/C11H16N4O3/c1-6(2)5-15-8-7(12-10(13-8)18-4)9(16)14(3)11(15)17/h6H,5H2,1-4H3,(H,12,13)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 2 from rat kidney


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033302
PNG
(Benzyl-(2-pyridin-4-yl-quinazolin-4-yl)-amine | CH...)
Show SMILES C(Nc1nc(nc2ccccc12)-c1ccncc1)c1ccccc1
Show InChI InChI=1S/C20H16N4/c1-2-6-15(7-3-1)14-22-20-17-8-4-5-9-18(17)23-19(24-20)16-10-12-21-13-11-16/h1-13H,14H2,(H,22,23,24)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86644
PNG
(BC11-38-2 | US9173884, BC11-38-2)
Show SMILES CCC(C)Sc1nc2CCSc2c(=O)n1-c1ccccc1
Show InChI InChI=1S/C16H18N2OS2/c1-3-11(2)21-16-17-13-9-10-20-14(13)15(19)18(16)12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
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n/an/a 1.84E+4n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033284
PNG
(Benzyl-(2-pyridin-3-yl-quinazolin-4-yl)-amine | CH...)
Show SMILES C(Nc1nc(nc2ccccc12)-c1cccnc1)c1ccccc1
Show InChI InChI=1S/C20H16N4/c1-2-7-15(8-3-1)13-22-20-17-10-4-5-11-18(17)23-19(24-20)16-9-6-12-21-14-16/h1-12,14H,13H2,(H,22,23,24)
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n/an/a 1.90E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033291
PNG
(Benzyl-(2-thiophen-2-yl-quinazolin-4-yl)-amine | C...)
Show SMILES C(Nc1nc(nc2ccccc12)-c1cccs1)c1ccccc1
Show InChI InChI=1S/C19H15N3S/c1-2-7-14(8-3-1)13-20-18-15-9-4-5-10-16(15)21-19(22-18)17-11-6-12-23-17/h1-12H,13H2,(H,20,21,22)
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n/an/a 2.10E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033296
PNG
(Benzyl-(2-phenyl-quinazolin-4-yl)-amine | CHEMBL72...)
Show SMILES C(Nc1nc(nc2ccccc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H17N3/c1-3-9-16(10-4-1)15-22-21-18-13-7-8-14-19(18)23-20(24-21)17-11-5-2-6-12-17/h1-14H,15H2,(H,22,23,24)
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n/an/a 2.40E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404744
PNG
(CHEMBL19047)
Show SMILES BrCCOc1cc(OCCBr)c2c(c1)oc(-c1ccc(OCCBr)c(OCCBr)c1)c(OCCBr)c2=O
Show InChI InChI=1S/C25H25Br5O7/c26-3-8-32-17-14-20(35-11-6-29)22-21(15-17)37-24(25(23(22)31)36-12-7-30)16-1-2-18(33-9-4-27)19(13-16)34-10-5-28/h1-2,13-15H,3-12H2
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n/an/a 2.45E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033290
PNG
(Benzyl-(2-imidazol-1-yl-quinazolin-4-yl)-amine | C...)
Show SMILES C(Nc1nc(nc2ccccc12)-n1ccnc1)c1ccccc1
Show InChI InChI=1S/C18H15N5/c1-2-6-14(7-3-1)12-20-17-15-8-4-5-9-16(15)21-18(22-17)23-11-10-19-13-23/h1-11,13H,12H2,(H,20,21,22)
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n/an/a 2.50E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86643
PNG
(BC11-38-1 | US9173884, BC11-38-1)
Show SMILES CCCCSc1nc2CCSc2c(=O)n1-c1ccccc1
Show InChI InChI=1S/C16H18N2OS2/c1-2-3-10-21-16-17-13-9-11-20-14(13)15(19)18(16)12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404740
PNG
(CHEMBL436338)
Show SMILES CCOc1cc(OCC(O)=O)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCC)c2=O
Show InChI InChI=1S/C25H28O9/c1-5-29-16-12-19(33-14-21(26)27)22-20(13-16)34-24(25(23(22)28)32-8-4)15-9-10-17(30-6-2)18(11-15)31-7-3/h9-13H,5-8,14H2,1-4H3,(H,26,27)
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n/an/a 4.80E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50033287
PNG
(Benzyl-(6-chloro-2-pyridin-3-yl-quinazolin-4-yl)-a...)
Show SMILES Clc1ccc2nc(nc(NCc3ccccc3)c2c1)-c1cccnc1
Show InChI InChI=1S/C20H15ClN4/c21-16-8-9-18-17(11-16)20(23-12-14-5-2-1-3-6-14)25-19(24-18)15-7-4-10-22-13-15/h1-11,13H,12H2,(H,23,24,25)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/a 6.31E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404743
PNG
(CHEMBL273765)
Show SMILES CCOc1cc(OCC)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCC(O)=O)c2=O
Show InChI InChI=1S/C25H28O9/c1-5-29-16-12-19(32-8-4)22-20(13-16)34-24(25(23(22)28)33-14-21(26)27)15-9-10-17(30-6-2)18(11-15)31-7-3/h9-13H,5-8,14H2,1-4H3,(H,26,27)
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n/an/a 7.10E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404745
PNG
(CHEMBL18262)
Show SMILES CCOc1cc(OCCN(CC)CC)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCC)c2=O
Show InChI InChI=1S/C29H39NO7/c1-7-30(8-2)15-16-36-24-18-21(32-9-3)19-25-26(24)27(31)29(35-12-6)28(37-25)20-13-14-22(33-10-4)23(17-20)34-11-5/h13-14,17-19H,7-12,15-16H2,1-6H3
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n/an/a 8.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 8.13E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404748
PNG
(CHEMBL19032 | NSC-115922)
Show SMILES COc1cc(OC)c2c(c1)oc(-c1ccc(OC)c(OC)c1)c(OC)c2=O
Show InChI InChI=1S/C20H20O7/c1-22-12-9-15(25-4)17-16(10-12)27-19(20(26-5)18(17)21)11-6-7-13(23-2)14(8-11)24-3/h6-10H,1-5H3
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n/an/a 9.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404739
PNG
(CHEMBL276918)
Show SMILES CCOc1cc(OCCBr)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCC)c2=O
Show InChI InChI=1S/C25H29BrO7/c1-5-28-17-14-20(32-12-11-26)22-21(15-17)33-24(25(23(22)27)31-8-4)16-9-10-18(29-6-2)19(13-16)30-7-3/h9-10,13-15H,5-8,11-12H2,1-4H3
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n/an/a 9.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86642
PNG
(BC11-38 | US9173884, BC11-38)
Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccccc1
Show InChI InChI=1S/C15H16N2OS2/c1-2-9-20-15-16-12-8-10-19-13(12)14(18)17(15)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86645
PNG
(BC11-38-3 | US9173884, BC11-38-3)
Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccc(C)cc1
Show InChI InChI=1S/C16H18N2OS2/c1-3-9-21-16-17-13-8-10-20-14(13)15(19)18(16)12-6-4-11(2)5-7-12/h4-7H,3,8-10H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM60812
PNG
(BDBM86641 | US9173884, BC11-28)
Show SMILES Cc1ccccc1Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(F)cc1
Show InChI InChI=1S/C25H19FN4/c1-17-7-5-6-10-22(17)29-24-23-21(18-8-3-2-4-9-18)15-30(25(23)28-16-27-24)20-13-11-19(26)12-14-20/h2-16H,1H3,(H,27,28,29)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM14363
PNG
(3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0...)
Show SMILES CCCOc1ccccc1-c1nc2nn[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
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n/an/a 1.00E+5n/an/an/an/an/an/a



Biofor Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat brain Phosphodiesterase 2


J Med Chem 38: 3547-57 (1995)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86639
PNG
(BC11-15 | US9173884, BC11-15)
Show SMILES CCN(CC)C(=O)c1cc(nc2n(nc(C)c12)-c1ccccc1C)-c1cccs1
Show InChI InChI=1S/C23H24N4OS/c1-5-26(6-2)23(28)17-14-18(20-12-9-13-29-20)24-22-21(17)16(4)25-27(22)19-11-8-7-10-15(19)3/h7-14H,5-6H2,1-4H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM60808
PNG
(BDBM86640 | US9173884, BC11-19)
Show SMILES O=c1nc2sc3ccccc3n2c(=O)n1-c1ccccc1
Show InChI InChI=1S/C15H9N3O2S/c19-13-16-14-18(11-8-4-5-9-12(11)21-14)15(20)17(13)10-6-2-1-3-7-10/h1-9H
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM86646
PNG
(BC11-38-4 | US9173884, BC11-38-4)
Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccccc1OC
Show InChI InChI=1S/C16H18N2O2S2/c1-3-9-22-16-17-11-8-10-21-14(11)15(19)18(16)12-6-4-5-7-13(12)20-2/h4-7H,3,8-10H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Boston College



Assay Description
In vitro enzyme assays were conducted via the Ba(OH)2 precipiation method using recombinant human PDE1C, PDE3B, PDE5A1, PDE6C, PDE8A, PDE9A2, PDE10A1...


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404741
PNG
(CHEMBL278972)
Show SMILES CCOc1cc(OCC)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCCN(CC)CC)c2=O
Show InChI InChI=1S/C29H39NO7/c1-7-30(8-2)15-16-36-29-27(31)26-24(35-12-6)18-21(32-9-3)19-25(26)37-28(29)20-13-14-22(33-10-4)23(17-20)34-11-5/h13-14,17-19H,7-12,15-16H2,1-6H3
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n/an/a 1.26E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404746
PNG
(NSC-115919 | PENTAACETYLQUERCETIN)
Show SMILES CC(=O)Oc1cc(OC(C)=O)c2c(c1)oc(-c1ccc(OC(C)=O)c(OC(C)=O)c1)c(OC(C)=O)c2=O
Show InChI InChI=1S/C25H20O12/c1-11(26)32-17-9-20(35-14(4)29)22-21(10-17)37-24(25(23(22)31)36-15(5)30)16-6-7-18(33-12(2)27)19(8-16)34-13(3)28/h6-10H,1-5H3
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n/an/a 2.75E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404742
PNG
(CHEMBL18487)
Show SMILES CCOc1cc(OCC)c2c(c1)oc(-c1ccc(OCC)c(OCC)c1)c(OCC)c2=O
Show InChI InChI=1S/C25H30O7/c1-6-27-17-14-20(30-9-4)22-21(15-17)32-24(25(23(22)26)31-10-5)16-11-12-18(28-7-2)19(13-16)29-8-3/h11-15H,6-10H2,1-5H3
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n/an/a 3.50E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404747
PNG
(CHEMBL18415)
Show SMILES CCOC(=O)COc1cc(OCC)cc2oc(-c3ccc(OCC)c(OCC)c3)c(OCC)c(=O)c12
Show InChI InChI=1S/C27H32O9/c1-6-30-18-14-21(35-16-23(28)33-9-4)24-22(15-18)36-26(27(25(24)29)34-10-5)17-11-12-19(31-7-2)20(13-17)32-8-3/h11-15H,6-10,16H2,1-5H3
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n/an/a 7.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50010981
PNG
((Ro 20-1724)4-(3-Butoxy-4-methoxy-benzyl)-imidazol...)
Show SMILES CCCCOc1cc(CC2CNC(=O)N2)ccc1OC
Show InChI InChI=1S/C15H22N2O3/c1-3-4-7-20-14-9-11(5-6-13(14)19-2)8-12-10-16-15(18)17-12/h5-6,9,12H,3-4,7-8,10H2,1-2H3,(H2,16,17,18)
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n/an/a 1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair
Phosphodiesterase 2A


(Rattus norvegicus)
BDBM50404738
PNG
(CHEMBL18609)
Show SMILES OCCOc1cc(OCCO)c2c(c1)oc(-c1ccc(OCCO)c(OCCO)c1)c(OCCO)c2=O
Show InChI InChI=1S/C25H30O12/c26-3-8-32-17-14-20(35-11-6-29)22-21(15-17)37-24(25(23(22)31)36-12-7-30)16-1-2-18(33-9-4-27)19(13-16)34-10-5-28/h1-2,13-15,26-30H,3-12H2
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n/an/a 1.30E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat brain particulate cGMP phosphodiesterase


J Med Chem 25: 1192-8 (1983)

More data for this
Ligand-Target Pair