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Compile Data Set for Download or QSAR

Found 63 hits for UniProtKB: Q63421   
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
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015800
PNG
(CHEMBL310041 | Diethyl-(1-ethyl-[1,2,4]triazolo[4,...)
Show SMILES CCN(CC)c1nc2ccccc2n2c(CC)nnc12
Show InChI InChI=1S/C15H19N5/c1-4-13-17-18-15-14(19(5-2)6-3)16-11-9-7-8-10-12(11)20(13)15/h7-10H,4-6H2,1-3H3
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Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM15336
PNG
(1-methyl-3-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-...)
Show SMILES CC(C)Cn1c2nc[nH]c2c(=O)n(C)c1=O
Show InChI InChI=1S/C10H14N4O2/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16/h5-6H,4H2,1-3H3,(H,11,12)
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Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50287545
PNG
(4-[4-Ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro...)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C(N)=O
Show InChI InChI=1S/C22H29N7O5S/c1-4-6-16-18-19(27(3)26-16)21(30)25-20(24-18)15-13-14(7-8-17(15)34-5-2)35(32,33)29-11-9-28(10-12-29)22(23)31/h7-8,13H,4-6,9-12H2,1-3H3,(H2,23,31)(H,24,25,30)
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n/an/a 110n/an/an/an/an/an/a



TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(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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TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(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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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50287543
PNG
(5-(2-ethoxy-5-(piperazin-1-ylsulfonyl)phenyl)-1-me...)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCNCC1
Show InChI InChI=1S/C21H28N6O4S/c1-4-6-16-18-19(26(3)25-16)21(28)24-20(23-18)15-13-14(7-8-17(15)31-5-2)32(29,30)27-11-9-22-10-12-27/h7-8,13,22H,4-6,9-12H2,1-3H3,(H,23,24,28)
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n/an/a 390n/an/an/an/an/an/a



TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100673
PNG
(CHEMBL538498 | methyl 2-(4-aminophenyl)-4-(4-bromo...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(Br)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C31H26BrN3O6/c1-38-25-14-18(15-26(39-2)28(25)32)27-23-12-11-22(41-17-20-6-4-5-13-34-20)16-24(23)30(36)35(29(27)31(37)40-3)21-9-7-19(33)8-10-21/h4-16H,17,33H2,1-3H3
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n/an/a 460n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50287550
PNG
(5-(2-ethoxy-5-(4-(2-hydroxyethyl)piperazin-1-ylsul...)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(CCO)CC1
Show InChI InChI=1S/C23H32N6O5S/c1-4-6-18-20-21(27(3)26-18)23(31)25-22(24-20)17-15-16(7-8-19(17)34-5-2)35(32,33)29-11-9-28(10-12-29)13-14-30/h7-8,15,30H,4-6,9-14H2,1-3H3,(H,24,25,31)
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TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100668
PNG
(CHEMBL542394 | ethyl 2-(4-aminophenyl)-1-oxo-7-(2-...)
Show SMILES CCOC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C33H31N3O7/c1-5-42-33(38)30-29(20-16-27(39-2)31(41-4)28(17-20)40-3)25-14-13-24(43-19-22-8-6-7-15-35-22)18-26(25)32(37)36(30)23-11-9-21(34)10-12-23/h6-18H,5,19,34H2,1-4H3
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n/an/a 550n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50111899
PNG
(5-(2-Ethoxy-phenyl)-1-methyl-3-propyl-1,6-dihydro-...)
Show SMILES CCCc1nn(C)c2c1nc([nH]c2=O)-c1ccccc1OCC
Show InChI InChI=1S/C17H20N4O2/c1-4-8-12-14-15(21(3)20-12)17(22)19-16(18-14)11-9-6-7-10-13(11)23-5-2/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19,22)
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TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50169640
PNG
(5-(2-Ethoxy-phenyl)-3-propyl-1,6-dihydro-pyrazolo[...)
Show SMILES CCCc1[nH]nc2c1nc([nH]c2=O)-c1ccccc1OCC
Show InChI InChI=1S/C16H18N4O2/c1-3-7-11-13-14(20-19-11)16(21)18-15(17-13)10-8-5-6-9-12(10)22-4-2/h5-6,8-9H,3-4,7H2,1-2H3,(H,19,20)(H,17,18,21)
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TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015773
PNG
((8-Chloro-1-trifluoromethyl-[1,2,4]triazolo[4,3-a]...)
Show SMILES CC(C)Nc1nc2ccc(Cl)cc2n2c(nnc12)C(F)(F)F
Show InChI InChI=1S/C13H11ClF3N5/c1-6(2)18-10-11-20-21-12(13(15,16)17)22(11)9-5-7(14)3-4-8(9)19-10/h3-6H,1-2H3,(H,18,19)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL


Assay Description
Binding affinity for Adenosine A1 receptor in cerebral cortices of Sprague-Dawley male rats using [3H]-CHA


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100667
PNG
(2-(4-Amino-phenyl)-7-methoxy-1-oxo-4-(3,4,5-trimet...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OC)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C27H26N2O7/c1-32-18-10-11-19-20(14-18)26(30)29(17-8-6-16(28)7-9-17)24(27(31)36-5)23(19)15-12-21(33-2)25(35-4)22(13-15)34-3/h6-14H,28H2,1-5H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100674
PNG
(CHEMBL541818 | methyl 2-(4-aminophenyl)-4-(3,5-dim...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(C)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C32H29N3O6/c1-19-27(38-2)15-20(16-28(19)39-3)29-25-13-12-24(41-18-22-7-5-6-14-34-22)17-26(25)31(36)35(30(29)32(37)40-4)23-10-8-21(33)9-11-23/h5-17H,18,33H2,1-4H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015780
PNG
(CHEMBL7033 | Diethyl-[1,2,4]triazolo[4,3-a]quinoxa...)
Show SMILES CCN(CC)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C13H15N5/c1-3-17(4-2)12-13-16-14-9-18(13)11-8-6-5-7-10(11)15-12/h5-9H,3-4H2,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100662
PNG
(CHEMBL553371 | CHEMBL77971 | methyl 2-(4-aminophen...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C32H29N3O7/c1-38-26-15-19(16-27(39-2)30(26)40-3)28-24-13-12-23(42-18-21-7-5-6-14-34-21)17-25(24)31(36)35(29(28)32(37)41-4)22-10-8-20(33)9-11-22/h5-17H,18,33H2,1-4H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015752
PNG
((8-Chloro-1-ethyl-[1,2,4]triazolo[4,3-a]quinoxalin...)
Show SMILES CCc1nnc2c(NC(C)C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C14H16ClN5/c1-4-12-18-19-14-13(16-8(2)3)17-10-6-5-9(15)7-11(10)20(12)14/h5-8H,4H2,1-3H3,(H,16,17)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015771
PNG
(1-Ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-ylamine...)
Show SMILES CCc1nnc2c(N)nc3ccccc3n12
Show InChI InChI=1S/C11H11N5/c1-2-9-14-15-11-10(12)13-7-5-3-4-6-8(7)16(9)11/h3-6H,2H2,1H3,(H2,12,13)
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Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100656
PNG
(2-(4-Amino-phenyl)-7-benzyloxy-1-oxo-4-(3,4,5-trim...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccc3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C33H30N2O7/c1-38-27-16-21(17-28(39-2)31(27)40-3)29-25-15-14-24(42-19-20-8-6-5-7-9-20)18-26(25)32(36)35(30(29)33(37)41-4)23-12-10-22(34)11-13-23/h5-18H,19,34H2,1-4H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100666
PNG
(6,7-Dimethoxy-2-methyl-1-oxo-4-(3,4,5-trimethoxy-p...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1C
Show InChI InChI=1S/C23H25NO8/c1-24-20(23(26)32-7)19(12-8-17(29-4)21(31-6)18(9-12)30-5)13-10-15(27-2)16(28-3)11-14(13)22(24)25/h8-11H,1-7H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100678
PNG
(2-(4-Amino-phenyl)-4-(4-hydroxy-3,5-dimethoxy-phen...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(O)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C31H27N3O7/c1-38-25-14-18(15-26(39-2)29(25)35)27-23-12-11-22(41-17-20-6-4-5-13-33-20)16-24(23)30(36)34(28(27)31(37)40-3)21-9-7-19(32)8-10-21/h4-16,35H,17,32H2,1-3H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015757
PNG
(4-Piperazin-1-yl-[1,2,4]triazolo[4,3-a]quinoxaline...)
Show SMILES C1CN(CCN1)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C13H14N6/c1-2-4-11-10(3-1)16-12(13-17-15-9-19(11)13)18-7-5-14-6-8-18/h1-4,9,14H,5-8H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL


Assay Description
Binding affinity for Adenosine A1 receptor in corpora striata of rats using [3H]NECA


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015749
PNG
((1-Ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-is...)
Show SMILES CCc1nnc2c(NC(C)C)nc3ccccc3n12
Show InChI InChI=1S/C14H17N5/c1-4-12-17-18-14-13(15-9(2)3)16-10-7-5-6-8-11(10)19(12)14/h5-9H,4H2,1-3H3,(H,15,16)
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Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100655
PNG
(2-Benzyl-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxy-p...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1Cc1ccccc1
Show InChI InChI=1S/C29H29NO8/c1-33-21-14-19-20(15-22(21)34-2)28(31)30(16-17-10-8-7-9-11-17)26(29(32)38-6)25(19)18-12-23(35-3)27(37-5)24(13-18)36-4/h7-15H,16H2,1-6H3
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n/an/a 3.10E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50287546
PNG
(5-(2-Ethoxy-phenyl)-1,3-dimethyl-1,6-dihydro-pyraz...)
Show SMILES CCOc1ccccc1-c1nc2c(C)nn(C)c2c(=O)[nH]1
Show InChI InChI=1S/C15H16N4O2/c1-4-21-11-8-6-5-7-10(11)14-16-12-9(2)18-19(3)13(12)15(20)17-14/h5-8H,4H2,1-3H3,(H,16,17,20)
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n/an/a 3.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Phosphodiesterase 5 from rabbit platelets


Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100653
PNG
(2-(4-Amino-phenyl)-6-methoxy-1-oxo-4-(3,4,5-trimet...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)ccc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C27H26N2O7/c1-32-18-10-11-19-20(14-18)23(15-12-21(33-2)25(35-4)22(13-15)34-3)24(27(31)36-5)29(26(19)30)17-8-6-16(28)7-9-17/h6-14H,28H2,1-5H3
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n/an/a 3.90E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100659
PNG
(CHEMBL544289 | methyl 2-(4-aminophenyl)-1-oxo-7-(3...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3cccnc3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C32H29N3O7/c1-38-26-14-20(15-27(39-2)30(26)40-3)28-24-12-11-23(42-18-19-6-5-13-34-17-19)16-25(24)31(36)35(29(28)32(37)41-4)22-9-7-21(33)8-10-22/h5-17H,18,33H2,1-4H3
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n/an/a 3.90E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(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 9.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL




Bioorg Med Chem Lett 6: 1819-1824 (1996)

More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100670
PNG
(CHEMBL553786 | methyl 2-(4-aminophenyl)-1-oxo-7-(4...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccncc3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C32H29N3O7/c1-38-26-15-20(16-27(39-2)30(26)40-3)28-24-10-9-23(42-18-19-11-13-34-14-12-19)17-25(24)31(36)35(29(28)32(37)41-4)22-7-5-21(33)6-8-22/h5-17H,18,33H2,1-4H3
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n/an/a 9.50E+3n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100665
PNG
(2-(4-Chloro-phenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-t...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H26ClNO8/c1-33-20-13-18-19(14-21(20)34-2)27(31)30(17-9-7-16(29)8-10-17)25(28(32)38-6)24(18)15-11-22(35-3)26(37-5)23(12-15)36-4/h7-14H,1-6H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100672
PNG
(2-(4-Amino-phenyl)-6,7-diethoxy-1-oxo-4-(3,4,5-tri...)
Show SMILES CCOc1cc2c(-c3cc(OC)c(OC)c(OC)c3)c(C(=O)OC)n(-c3ccc(N)cc3)c(=O)c2cc1OCC
Show InChI InChI=1S/C30H32N2O8/c1-7-39-22-15-20-21(16-23(22)40-8-2)29(33)32(19-11-9-18(31)10-12-19)27(30(34)38-6)26(20)17-13-24(35-3)28(37-5)25(14-17)36-4/h9-16H,7-8,31H2,1-6H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100675
PNG
(3N,3N-dimethyl-2-(4-aminophenyl)-1-oxo-7-(2-pyridy...)
Show SMILES COc1cc(cc(OC)c1OC)-c1c(C(=O)N(C)C)n(-c2ccc(N)cc2)c(=O)c2cc(OCc3ccccn3)ccc12
Show InChI InChI=1S/C33H32N4O6/c1-36(2)33(39)30-29(20-16-27(40-3)31(42-5)28(17-20)41-4)25-14-13-24(43-19-22-8-6-7-15-35-22)18-26(25)32(38)37(30)23-11-9-21(34)10-12-23/h6-18H,19,34H2,1-5H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100677
PNG
(6,7-Dimethoxy-2-(4-methoxy-phenyl)-1-oxo-4-(3,4,5-...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(OC)cc1
Show InChI InChI=1S/C29H29NO9/c1-33-18-10-8-17(9-11-18)30-26(29(32)39-7)25(16-12-23(36-4)27(38-6)24(13-16)37-5)19-14-21(34-2)22(35-3)15-20(19)28(30)31/h8-15H,1-7H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100652
PNG
(6,7-Dimethoxy-1-oxo-2-piperidin-1-yl-4-(3,4,5-trim...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1N1CCCCC1
Show InChI InChI=1S/C27H32N2O8/c1-32-19-14-17-18(15-20(19)33-2)26(30)29(28-10-8-7-9-11-28)24(27(31)37-6)23(17)16-12-21(34-3)25(36-5)22(13-16)35-4/h12-15H,7-11H2,1-6H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100664
PNG
(2-(4-Amino-phenyl)-1-oxo-7-(2-pyridin-2-yl-ethoxy)...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C33H31N3O7/c1-39-27-17-20(18-28(40-2)31(27)41-3)29-25-13-12-24(43-16-14-22-7-5-6-15-35-22)19-26(25)32(37)36(30(29)33(38)42-4)23-10-8-21(34)9-11-23/h5-13,15,17-19H,14,16,34H2,1-4H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100680
PNG
(2-(4-aminophenyl)-1-oxo-7-(2-pyridylmethoxy)-4-(3,...)
Show SMILES COc1cc(cc(OC)c1OC)-c1c(C(N)=O)n(-c2ccc(N)cc2)c(=O)c2cc(OCc3ccccn3)ccc12
Show InChI InChI=1S/C31H28N4O6/c1-38-25-14-18(15-26(39-2)29(25)40-3)27-23-12-11-22(41-17-20-6-4-5-13-34-20)16-24(23)31(37)35(28(27)30(33)36)21-9-7-19(32)8-10-21/h4-16H,17,32H2,1-3H3,(H2,33,36)
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100681
PNG
(2-(4-Dimethylamino-phenyl)-6,7-dimethoxy-1-oxo-4-(...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(cc1)N(C)C
Show InChI InChI=1S/C30H32N2O8/c1-31(2)18-9-11-19(12-10-18)32-27(30(34)40-8)26(17-13-24(37-5)28(39-7)25(14-17)38-6)20-15-22(35-3)23(36-4)16-21(20)29(32)33/h9-16H,1-8H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100669
PNG
(2-(4-Acetylamino-phenyl)-6,7-dimethoxy-1-oxo-4-(3,...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(NC(C)=O)cc1
Show InChI InChI=1S/C30H30N2O9/c1-16(33)31-18-8-10-19(11-9-18)32-27(30(35)41-7)26(17-12-24(38-4)28(40-6)25(13-17)39-5)20-14-22(36-2)23(37-3)15-21(20)29(32)34/h8-15H,1-7H3,(H,31,33)
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100676
PNG
(2-(4-Amino-phenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-tr...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C28H28N2O8/c1-33-20-13-18-19(14-21(20)34-2)27(31)30(17-9-7-16(29)8-10-17)25(28(32)38-6)24(18)15-11-22(35-3)26(37-5)23(12-15)36-4/h7-14H,29H2,1-6H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100671
PNG
(3N-methyl-2-(4-aminophenyl)-1-oxo-7-(2-pyridylmeth...)
Show SMILES CNC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccc(OCc3ccccn3)cc2c(=O)n1-c1ccc(N)cc1
Show InChI InChI=1S/C32H30N4O6/c1-34-31(37)29-28(19-15-26(39-2)30(41-4)27(16-19)40-3)24-13-12-23(42-18-21-7-5-6-14-35-21)17-25(24)32(38)36(29)22-10-8-20(33)9-11-22/h5-17H,18,33H2,1-4H3,(H,34,37)
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100683
PNG
(2-(4-aminophenyl)-1-oxo-7-(2-pyridylmethoxy)-4-(3,...)
Show SMILES COc1cc(cc(OC)c1OC)-c1c(C(O)=O)n(-c2ccc(N)cc2)c(=O)c2cc(OCc3ccccn3)ccc12
Show InChI InChI=1S/C31H27N3O7/c1-38-25-14-18(15-26(39-2)29(25)40-3)27-23-12-11-22(41-17-20-6-4-5-13-33-20)16-24(23)30(35)34(28(27)31(36)37)21-9-7-19(32)8-10-21/h4-16H,17,32H2,1-3H3,(H,36,37)
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100682
PNG
(2-Cyclohexyl-6,7-dimethoxy-1-oxo-4-(3,4,5-trimetho...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1C1CCCCC1
Show InChI InChI=1S/C28H33NO8/c1-32-20-14-18-19(15-21(20)33-2)27(30)29(17-10-8-7-9-11-17)25(28(31)37-6)24(18)16-12-22(34-3)26(36-5)23(13-16)35-4/h12-15,17H,7-11H2,1-6H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100684
PNG
(6,7-Dimethoxy-2-(4-methylamino-phenyl)-1-oxo-4-(3,...)
Show SMILES CNc1ccc(cc1)-n1c(C(=O)OC)c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c1=O
Show InChI InChI=1S/C29H30N2O8/c1-30-17-8-10-18(11-9-17)31-26(29(33)39-7)25(16-12-23(36-4)27(38-6)24(13-16)37-5)19-14-21(34-2)22(35-3)15-20(19)28(31)32/h8-15,30H,1-7H3
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Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015798
PNG
(8-Chloro-1-trifluoromethyl-[1,2,4]triazolo[4,3-a]q...)
Show SMILES Nc1nc2ccc(Cl)cc2n2c(nnc12)C(F)(F)F
Show InChI InChI=1S/C10H5ClF3N5/c11-4-1-2-5-6(3-4)19-8(7(15)16-5)17-18-9(19)10(12,13)14/h1-3H,(H2,15,16)
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Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015769
PNG
(8-Fluoro-[1,2,4]triazolo[4,3-a]quinoxalin-4-ylamin...)
Show SMILES Nc1nc2ccc(F)cc2n2cnnc12
Show InChI InChI=1S/C9H6FN5/c10-5-1-2-6-7(3-5)15-4-12-14-9(15)8(11)13-6/h1-4H,(H2,11,13)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015770
PNG
(CHEMBL306351 | Cyclohexyl-(8-fluoro-1-trifluoromet...)
Show SMILES Fc1ccc2nc(NC3CCCCC3)c3nnc(n3c2c1)C(F)(F)F
Show InChI InChI=1S/C16H15F4N5/c17-9-6-7-11-12(8-9)25-14(23-24-15(25)16(18,19)20)13(22-11)21-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50015803
PNG
((8-Chloro-1-trifluoromethyl-[1,2,4]triazolo[4,3-a]...)
Show SMILES FC(F)(F)c1nnc2c(NC3CCCCC3)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C16H15ClF3N5/c17-9-6-7-11-12(8-9)25-14(23-24-15(25)16(18,19)20)13(22-11)21-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL




Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100661
PNG
(2-(4-Hydroxy-phenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1-c1ccc(O)cc1
Show InChI InChI=1S/C28H27NO9/c1-33-20-13-18-19(14-21(20)34-2)27(31)29(16-7-9-17(30)10-8-16)25(28(32)38-6)24(18)15-11-22(35-3)26(37-5)23(12-15)36-4/h7-14,30H,1-6H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100657
PNG
(6,7-Dimethoxy-1-oxo-4-(3,4,5-trimethoxy-phenyl)-1,...)
Show SMILES COC(=O)c1[nH]c(=O)c2cc(OC)c(OC)cc2c1-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C22H23NO8/c1-26-14-9-12-13(10-15(14)27-2)21(24)23-19(22(25)31-6)18(12)11-7-16(28-3)20(30-5)17(8-11)29-4/h7-10H,1-6H3,(H,23,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Rattus norvegicus)
BDBM50100654
PNG
(2-Cyclopentyl-6,7-dimethoxy-1-oxo-4-(3,4,5-trimeth...)
Show SMILES COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)c(OC)cc2c(=O)n1C1CCCC1
Show InChI InChI=1S/C27H31NO8/c1-31-19-13-17-18(14-20(19)32-2)26(29)28(16-9-7-8-10-16)24(27(30)36-6)23(17)15-11-21(33-3)25(35-5)22(12-15)34-4/h11-14,16H,7-10H2,1-6H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)


Citation and Details
More data for this
Ligand-Target Pair
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