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Patent code US10618913

Compile Data Set for Download or QSAR
Found 114 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
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279088
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
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n/an/a 0.270n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438746
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ncccc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O2/c1-16(2)31-24-20-14-19(29-23(24)17(3)30-31)18-8-6-11-27-25(18)33-13-5-4-12-32-22-9-7-10-26-21(22)15-28-20/h6-11,14,16,28H,4-5,12-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438746
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ncccc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O2/c1-16(2)31-24-20-14-19(29-23(24)17(3)30-31)18-8-6-11-27-25(18)33-13-5-4-12-32-22-9-7-10-26-21(22)15-28-20/h6-11,14,16,28H,4-5,12-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438725
PNG
(21-isopropyl-23-methyl-21H-6,9,12-trioxa-3- aza-2(...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCOCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O3/c1-16(2)31-23-21-14-20(29-22(23)17(3)30-31)19-7-5-9-27-25(19)34-13-11-32-10-12-33-24-18(15-28-21)6-4-8-26-24/h4-9,14,16,28H,10-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279037
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-6-15(3)30-22-20(25-14-17-10-12-29(5)28-17)13-19(26-21(22)16(4)27-30)18-9-8-11-24-23(18)31-7-2/h8-13,15H,6-7,14H2,1-5H3,(H,25,26)
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n/an/a 0.640n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279168
PNG
(5-(2-ethoxypyridin-3-yl)-3-(fluoromethyl)-1-isopro...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(CF)c2n1)C(C)C
Show InChI InChI=1S/C22H26FN7O/c1-5-31-22-16(7-6-8-24-22)17-9-18(25-11-15-12-26-29(4)13-15)21-20(27-17)19(10-23)28-30(21)14(2)3/h6-9,12-14H,5,10-11H2,1-4H3,(H,25,27)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279039
PNG
(5-(2-ethoxy-3-pyridyl)-1-[1-methylpropyl]-N-[(1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C(C)CC
Show InChI InChI=1S/C22H27N7O/c1-5-15(3)29-21-19(24-11-16-12-25-28(4)14-16)10-18(27-20(21)13-26-29)17-8-7-9-23-22(17)30-6-2/h7-10,12-15H,5-6,11H2,1-4H3,(H,24,27)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438722
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES COc1ccc(CN2Cc3cccnc3OCCCCOc3ncccc3-c3cc2c2n(nc(C)c2n3)C(C)C)cc1
Show InChI InChI=1S/C33H36N6O3/c1-22(2)39-31-29-19-28(36-30(31)23(3)37-39)27-10-8-16-35-33(27)42-18-6-5-17-41-32-25(9-7-15-34-32)21-38(29)20-24-11-13-26(40-4)14-12-24/h7-16,19,22H,5-6,17-18,20-21H2,1-4H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438723
PNG
(21-isopropyl-23-methyl-21H-6,12-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C26H30N6O2/c1-17(2)32-24-22-15-21(30-23(24)18(3)31-32)20-10-8-12-28-26(20)34-14-6-4-5-13-33-25-19(16-29-22)9-7-11-27-25/h7-12,15,17,29H,4-6,13-14,16H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278971
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(5-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nnc(C)o2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H25N7O2/c1-6-29-21-15(8-7-9-22-21)16-10-17(23-11-18-26-25-14(5)30-18)20-19(24-16)13(4)27-28(20)12(2)3/h7-10,12H,6,11H2,1-5H3,(H,23,24)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279116
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nccs1
Show InChI InChI=1S/C18H21N7S/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279153
PNG
(3-(difluoromethyl)-5-(2-ethoxypyridin-3-yl)-1-isop...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C(F)F)c2n1)C(C)C
Show InChI InChI=1S/C22H25F2N7O/c1-5-32-22-15(7-6-8-25-22)16-9-17(26-10-14-11-27-30(4)12-14)20-18(28-16)19(21(23)24)29-31(20)13(2)3/h6-9,11-13,21H,5,10H2,1-4H3,(H,26,28)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279137
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncco1
Show InChI InChI=1S/C18H21N7O/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438725
PNG
(21-isopropyl-23-methyl-21H-6,9,12-trioxa-3- aza-2(...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCOCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O3/c1-16(2)31-23-21-14-20(29-22(23)17(3)30-31)19-7-5-9-27-25(19)34-13-11-32-10-12-33-24-18(15-28-21)6-4-8-26-24/h4-9,14,16,28H,10-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438746
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ncccc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O2/c1-16(2)31-24-20-14-19(29-23(24)17(3)30-31)18-8-6-11-27-25(18)33-13-5-4-12-32-22-9-7-10-26-21(22)15-28-20/h6-11,14,16,28H,4-5,12-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438724
PNG
(21-isopropyl-23-methyl-21H-6,10-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-15(2)30-22-20-13-19(28-21(22)16(3)29-30)18-8-5-10-26-24(18)32-12-6-11-31-23-17(14-27-20)7-4-9-25-23/h4-5,7-10,13,15,27H,6,11-12,14H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279088
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438735
PNG
(21-isopropyl-23-methyl-21H,51H-11-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H29N7O/c1-16(2)31-23-21-14-20(28-22(23)17(3)29-31)19-8-7-10-25-24(19)32-13-6-4-5-12-30-18(15-26-21)9-11-27-30/h7-11,14,16,26H,4-6,12-13,15H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279082
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(2-methylthiazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2csc(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H24N6O2S/c1-4-30-22-17(6-5-7-23-22)18-8-19(24-9-15-12-31-14(3)25-15)21-20(26-18)13(2)27-28(21)16-10-29-11-16/h5-8,12,16H,4,9-11H2,1-3H3,(H,24,26)
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n/an/a 5.70n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279134
PNG
(N-[[1-(difluoromethyl)pyrazol-4-yl]methyl]-5-(2-et...)
Show SMILES CCOc1ncccc1-c1cc(N(Cc2cnn(c2)C(F)F)Cc2ccc(OC)cc2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C30H33F2N7O2/c1-6-41-29-24(8-7-13-33-29)25-14-26(28-27(35-25)20(4)36-39(28)19(2)3)37(16-21-9-11-23(40-5)12-10-21)17-22-15-34-38(18-22)30(31)32/h7-15,18-19,30H,6,16-17H2,1-5H3
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n/an/a 5.90n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279018
PNG
(5-(2-ethoxypyridin-3-yl)-1-ethyl-3-methyl-N-((1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)nc(C)c2n1
Show InChI InChI=1S/C21H25N7O/c1-5-28-20-18(23-11-15-12-24-27(4)13-15)10-17(25-19(20)14(3)26-28)16-8-7-9-22-21(16)29-6-2/h7-10,12-13H,5-6,11H2,1-4H3,(H,23,25)
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n/an/a 6.30n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM425070
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(2-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncnn2C)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H26N8O/c1-6-30-21-15(8-7-9-22-21)16-10-17(23-11-18-24-12-25-28(18)5)20-19(26-16)14(4)27-29(20)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,23,26)
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n/an/a 6.60n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279168
PNG
(5-(2-ethoxypyridin-3-yl)-3-(fluoromethyl)-1-isopro...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(CF)c2n1)C(C)C
Show InChI InChI=1S/C22H26FN7O/c1-5-31-22-16(7-6-8-24-22)17-9-18(25-11-15-12-26-29(4)13-15)21-20(27-17)19(10-23)28-30(21)14(2)3/h6-9,12-14H,5,10-11H2,1-4H3,(H,25,27)
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n/an/a 7.40n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279088
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
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n/an/a 7.60n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279037
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-6-15(3)30-22-20(25-14-17-10-12-29(5)28-17)13-19(26-21(22)16(4)27-30)18-9-8-11-24-23(18)31-7-2/h8-13,15H,6-7,14H2,1-5H3,(H,25,26)
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n/an/a 9.60n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438750
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4nccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H27N7O2/c1-15(2)31-22-19-13-18(29-21(22)16(3)30-31)17-7-6-8-26-23(17)32-11-4-5-12-33-24-20(14-28-19)25-9-10-27-24/h6-10,13,15,28H,4-5,11-12,14H2,1-3H3
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n/an/a 10n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279116
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nccs1
Show InChI InChI=1S/C18H21N7S/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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n/an/a 12n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438722
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES COc1ccc(CN2Cc3cccnc3OCCCCOc3ncccc3-c3cc2c2n(nc(C)c2n3)C(C)C)cc1
Show InChI InChI=1S/C33H36N6O3/c1-22(2)39-31-29-19-28(36-30(31)23(3)37-39)27-10-8-16-35-33(27)42-18-6-5-17-41-32-25(9-7-15-34-32)21-38(29)20-24-11-13-26(40-4)14-12-24/h7-16,19,22H,5-6,17-18,20-21H2,1-4H3
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n/an/a 12n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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n/an/a 13n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279166
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-3-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccnc2OC)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C24H26N6O3/c1-4-33-24-18(8-6-10-26-24)19-11-20(27-12-16-7-5-9-25-23(16)31-3)22-21(28-19)15(2)29-30(22)17-13-32-14-17/h5-11,17H,4,12-14H2,1-3H3,(H,27,28)
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n/an/a 13n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279153
PNG
(3-(difluoromethyl)-5-(2-ethoxypyridin-3-yl)-1-isop...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C(F)F)c2n1)C(C)C
Show InChI InChI=1S/C22H25F2N7O/c1-5-32-22-15(7-6-8-25-22)16-9-17(26-10-14-11-27-30(4)12-14)20-18(28-16)19(21(23)24)29-31(20)13(2)3/h6-9,11-13,21H,5,10H2,1-4H3,(H,26,28)
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n/an/a 13n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279039
PNG
(5-(2-ethoxy-3-pyridyl)-1-[1-methylpropyl]-N-[(1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C(C)CC
Show InChI InChI=1S/C22H27N7O/c1-5-15(3)29-21-19(24-11-16-12-25-28(4)14-16)10-18(27-20(21)13-26-29)17-8-7-9-23-22(17)30-6-2/h7-10,12-15H,5-6,11H2,1-4H3,(H,24,27)
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279137
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncco1
Show InChI InChI=1S/C18H21N7O/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279132
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methyl-1,2,4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncn(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C21H24N8O2/c1-4-31-21-15(6-5-7-22-21)16-8-17(23-9-18-24-12-28(3)27-18)20-19(25-16)13(2)26-29(20)14-10-30-11-14/h5-8,12,14H,4,9-11H2,1-3H3,(H,23,25)
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278983
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(1-methylpyrazol-4-yl)me...)
Show SMILES CCCn1ncc2nc(cc(NCc3cnn(C)c3)c12)-c1cccnc1OCC
Show InChI InChI=1S/C21H25N7O/c1-4-9-28-20-18(23-11-15-12-24-27(3)14-15)10-17(26-19(20)13-25-28)16-7-6-8-22-21(16)29-5-2/h6-8,10,12-14H,4-5,9,11H2,1-3H3,(H,23,26)
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n/an/a 15n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438749
PNG
(21-isopropyl-23-methyl-21H,51H-10-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCOc4ncccc-34)c12
Show InChI InChI=1S/C23H27N7O/c1-15(2)30-22-20-13-19(27-21(22)16(3)28-30)18-7-6-9-24-23(18)31-12-5-4-11-29-17(14-25-20)8-10-26-29/h6-10,13,15,25H,4-5,11-12,14H2,1-3H3
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n/an/a 15n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438725
PNG
(21-isopropyl-23-methyl-21H-6,9,12-trioxa-3- aza-2(...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCOCCOc4ncccc-34)c12
Show InChI InChI=1S/C25H28N6O3/c1-16(2)31-23-21-14-20(29-22(23)17(3)30-31)19-7-5-9-27-25(19)34-13-11-32-10-12-33-24-18(15-28-21)6-4-8-26-24/h4-9,14,16,28H,10-13,15H2,1-3H3
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n/an/a 16n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438750
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4nccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H27N7O2/c1-15(2)31-22-19-13-18(29-21(22)16(3)30-31)17-7-6-8-26-23(17)32-11-4-5-12-33-24-20(14-28-19)25-9-10-27-24/h6-10,13,15,28H,4-5,11-12,14H2,1-3H3
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n/an/a 17n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438723
PNG
(21-isopropyl-23-methyl-21H-6,12-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C26H30N6O2/c1-17(2)32-24-22-15-21(30-23(24)18(3)31-32)20-10-8-12-28-26(20)34-14-6-4-5-13-33-25-19(16-29-22)9-7-11-27-25/h7-12,15,17,29H,4-6,13-14,16H2,1-3H3
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279169
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ocnc1C
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-22-25(5)9-14)6-16(19-13(4)21-10-27-19)23-17(18)12(3)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278971
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(5-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nnc(C)o2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H25N7O2/c1-6-29-21-15(8-7-9-22-21)16-10-17(23-11-18-26-25-14(5)30-18)20-19(24-16)13(4)27-28(20)12(2)3/h7-10,12H,6,11H2,1-5H3,(H,23,24)
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438722
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES COc1ccc(CN2Cc3cccnc3OCCCCOc3ncccc3-c3cc2c2n(nc(C)c2n3)C(C)C)cc1
Show InChI InChI=1S/C33H36N6O3/c1-22(2)39-31-29-19-28(36-30(31)23(3)37-39)27-10-8-16-35-33(27)42-18-6-5-17-41-32-25(9-7-15-34-32)21-38(29)20-24-11-13-26(40-4)14-12-24/h7-16,19,22H,5-6,17-18,20-21H2,1-4H3
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n/an/a 20n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM424936
PNG
(US10512632, Example 26 | US10618913, Example S26)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)ncc2n1
Show InChI InChI=1S/C20H23N7O/c1-4-27-19-17(22-10-14-11-23-26(3)13-14)9-16(25-18(19)12-24-27)15-7-6-8-21-20(15)28-5-2/h6-9,11-13H,4-5,10H2,1-3H3,(H,22,25)
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n/an/a 22n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438735
PNG
(21-isopropyl-23-methyl-21H,51H-11-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H29N7O/c1-16(2)31-23-21-14-20(28-22(23)17(3)29-31)19-8-7-10-25-24(19)32-13-6-4-5-12-30-18(15-26-21)9-11-27-30/h7-11,14,16,26H,4-6,12-13,15H2,1-3H3
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n/an/a 25n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279168
PNG
(5-(2-ethoxypyridin-3-yl)-3-(fluoromethyl)-1-isopro...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(CF)c2n1)C(C)C
Show InChI InChI=1S/C22H26FN7O/c1-5-31-22-16(7-6-8-24-22)17-9-18(25-11-15-12-26-29(4)13-15)21-20(27-17)19(10-23)28-30(21)14(2)3/h6-9,12-14H,5,10-11H2,1-4H3,(H,25,27)
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n/an/a 26n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279037
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-1-[1-methylpropyl]...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-6-15(3)30-22-20(25-14-17-10-12-29(5)28-17)13-19(26-21(22)16(4)27-30)18-9-8-11-24-23(18)31-7-2/h8-13,15H,6-7,14H2,1-5H3,(H,25,26)
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279116
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nccs1
Show InChI InChI=1S/C18H21N7S/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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n/an/a 28n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279137
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncco1
Show InChI InChI=1S/C18H21N7O/c1-11(2)25-17-14(20-8-13-9-21-24(4)10-13)7-15(18-19-5-6-26-18)22-16(17)12(3)23-25/h5-7,9-11H,8H2,1-4H3,(H,20,22)
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n/an/a 36n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438748
PNG
(21-ethyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7)-py...)
Show SMILES CCn1nc(C)c2nc-3cc(NCc4cccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-3-30-22-20-14-19(28-21(22)16(2)29-30)18-9-7-11-26-24(18)32-13-5-4-12-31-23-17(15-27-20)8-6-10-25-23/h6-11,14,27H,3-5,12-13,15H2,1-2H3
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n/an/a 36n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438724
PNG
(21-isopropyl-23-methyl-21H-6,10-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-15(2)30-22-20-13-19(28-21(22)16(3)29-30)18-8-5-10-26-24(18)32-12-6-11-31-23-17(14-27-20)7-4-9-25-23/h4-5,7-10,13,15,27H,6,11-12,14H2,1-3H3
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n/an/a 38n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278984
PNG
(5-(2-ethoxypyridin-3-yl)-N-((1-methyl-1H-pyrazol-4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C1COC1
Show InChI InChI=1S/C21H23N7O2/c1-3-30-21-16(5-4-6-22-21)17-7-18(23-8-14-9-24-27(2)11-14)20-19(26-17)10-25-28(20)15-12-29-13-15/h4-7,9-11,15H,3,8,12-13H2,1-2H3,(H,23,26)
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n/an/a 38n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278993
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-(m-tolylmethy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccc(C)c2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C24H27N5O/c1-5-30-24-19(10-7-11-25-24)20-13-21(26-14-18-9-6-8-17(4)12-18)23-22(28-20)15-27-29(23)16(2)3/h6-13,15-16H,5,14H2,1-4H3,(H,26,28)
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n/an/a 38n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279018
PNG
(5-(2-ethoxypyridin-3-yl)-1-ethyl-3-methyl-N-((1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)nc(C)c2n1
Show InChI InChI=1S/C21H25N7O/c1-5-28-20-18(23-11-15-12-24-27(4)13-15)10-17(25-19(20)14(3)26-28)16-8-7-9-22-21(16)29-6-2/h7-10,12-13H,5-6,11H2,1-4H3,(H,23,25)
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n/an/a 38n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278971
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(5-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nnc(C)o2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H25N7O2/c1-6-29-21-15(8-7-9-22-21)16-10-17(23-11-18-26-25-14(5)30-18)20-19(24-16)13(4)27-28(20)12(2)3/h7-10,12H,6,11H2,1-5H3,(H,23,24)
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n/an/a 40n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279039
PNG
(5-(2-ethoxy-3-pyridyl)-1-[1-methylpropyl]-N-[(1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C(C)CC
Show InChI InChI=1S/C22H27N7O/c1-5-15(3)29-21-19(24-11-16-12-25-28(4)14-16)10-18(27-20(21)13-26-29)17-8-7-9-23-22(17)30-6-2/h7-10,12-15H,5-6,11H2,1-4H3,(H,24,27)
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n/an/a 40n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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n/an/a 44n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279011
PNG
(N-benzyl-5-(2-ethoxy-3-pyridyl)-1-isopropyl-pyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccccc2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C23H25N5O/c1-4-29-23-18(11-8-12-24-23)19-13-20(25-14-17-9-6-5-7-10-17)22-21(27-19)15-26-28(22)16(2)3/h5-13,15-16H,4,14H2,1-3H3,(H,25,27)
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n/an/a 45n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279153
PNG
(3-(difluoromethyl)-5-(2-ethoxypyridin-3-yl)-1-isop...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C(F)F)c2n1)C(C)C
Show InChI InChI=1S/C22H25F2N7O/c1-5-32-22-15(7-6-8-25-22)16-9-17(26-10-14-11-27-30(4)12-14)20-18(28-16)19(21(23)24)29-31(20)13(2)3/h6-9,11-13,21H,5,10H2,1-4H3,(H,26,28)
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n/an/a 45n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438749
PNG
(21-isopropyl-23-methyl-21H,51H-10-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCOc4ncccc-34)c12
Show InChI InChI=1S/C23H27N7O/c1-15(2)30-22-20-13-19(27-21(22)16(3)28-30)18-7-6-9-24-23(18)31-12-5-4-11-29-17(14-25-20)8-10-26-29/h6-10,13,15,25H,4-5,11-12,14H2,1-3H3
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n/an/a 53n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278987
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-[(1-methylimi...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nccn2C)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C21H25N7O/c1-5-29-21-15(7-6-8-23-21)16-11-17(24-13-19-22-9-10-27(19)4)20-18(26-16)12-25-28(20)14(2)3/h6-12,14H,5,13H2,1-4H3,(H,24,26)
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n/an/a 54n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438723
PNG
(21-isopropyl-23-methyl-21H-6,12-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C26H30N6O2/c1-17(2)32-24-22-15-21(30-23(24)18(3)31-32)20-10-8-12-28-26(20)34-14-6-4-5-13-33-25-19(16-29-22)9-7-11-27-25/h7-12,15,17,29H,4-6,13-14,16H2,1-3H3
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n/an/a 54n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438749
PNG
(21-isopropyl-23-methyl-21H,51H-10-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCOc4ncccc-34)c12
Show InChI InChI=1S/C23H27N7O/c1-15(2)30-22-20-13-19(27-21(22)16(3)28-30)18-7-6-9-24-23(18)31-12-5-4-11-29-17(14-25-20)8-10-26-29/h6-10,13,15,25H,4-5,11-12,14H2,1-3H3
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n/an/a 56n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM425070
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(2-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncnn2C)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H26N8O/c1-6-30-21-15(8-7-9-22-21)16-10-17(23-11-18-24-12-25-28(18)5)20-19(26-16)14(4)27-29(20)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,23,26)
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n/an/a 60n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278982
PNG
(1-cyclopropyl-5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1CC1
Show InChI InChI=1S/C22H25N7O/c1-4-30-22-17(6-5-9-23-22)18-10-19(24-11-15-12-25-28(3)13-15)21-20(26-18)14(2)27-29(21)16-7-8-16/h5-6,9-10,12-13,16H,4,7-8,11H2,1-3H3,(H,24,26)
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n/an/a 60n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438724
PNG
(21-isopropyl-23-methyl-21H-6,10-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4cccnc4OCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-15(2)30-22-20-13-19(28-21(22)16(3)29-30)18-8-5-10-26-24(18)32-12-6-11-31-23-17(14-27-20)7-4-9-25-23/h4-5,7-10,13,15,27H,6,11-12,14H2,1-3H3
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n/an/a 69n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279134
PNG
(N-[[1-(difluoromethyl)pyrazol-4-yl]methyl]-5-(2-et...)
Show SMILES CCOc1ncccc1-c1cc(N(Cc2cnn(c2)C(F)F)Cc2ccc(OC)cc2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C30H33F2N7O2/c1-6-41-29-24(8-7-13-33-29)25-14-26(28-27(35-25)20(4)36-39(28)19(2)3)37(16-21-9-11-23(40-5)12-10-21)17-22-15-34-38(18-22)30(31)32/h7-15,18-19,30H,6,16-17H2,1-5H3
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n/an/a 73n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438735
PNG
(21-isopropyl-23-methyl-21H,51H-11-oxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4ccnn4CCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H29N7O/c1-16(2)31-23-21-14-20(28-22(23)17(3)29-31)19-8-7-10-25-24(19)32-13-6-4-5-12-30-18(15-26-21)9-11-27-30/h7-11,14,16,26H,4-6,12-13,15H2,1-3H3
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n/an/a 80n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM278998
PNG
(5-(2-ethoxy-3-pyridyl)-1,3-dimethyl-N-[(1-methylpy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(C)nc(C)c2n1
Show InChI InChI=1S/C20H23N7O/c1-5-28-20-15(7-6-8-21-20)16-9-17(22-10-14-11-23-26(3)12-14)19-18(24-16)13(2)25-27(19)4/h6-9,11-12H,5,10H2,1-4H3,(H,22,24)
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n/an/a 85n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279138
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cnnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-18-15(19-7-13-8-21-25(4)10-13)6-14(16-9-20-24-26(16)5)22-17(18)12(3)23-27/h6,8-11H,7H2,1-5H3,(H,19,22)
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n/an/a 85n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278983
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(1-methylpyrazol-4-yl)me...)
Show SMILES CCCn1ncc2nc(cc(NCc3cnn(C)c3)c12)-c1cccnc1OCC
Show InChI InChI=1S/C21H25N7O/c1-4-9-28-20-18(23-11-15-12-24-27(3)14-15)10-17(26-19(20)13-25-28)16-7-6-8-22-21(16)29-5-2/h6-8,10,12-14H,4-5,9,11H2,1-3H3,(H,23,26)
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n/an/a 90n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438747
PNG
(21,23-dimethyl-21H-6,11-dioxa-3-aza-2(5,7)- pyrazo...)
Show SMILES Cc1nn(C)c2c3NCc4cccnc4OCCCCOc4ncccc4-c(c3)nc12
Show InChI InChI=1S/C23H24N6O2/c1-15-20-21(29(2)28-15)19-13-18(27-20)17-8-6-10-25-23(17)31-12-4-3-11-30-22-16(14-26-19)7-5-9-24-22/h5-10,13,26H,3-4,11-12,14H2,1-2H3
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n/an/a 95n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279169
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ocnc1C
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-22-25(5)9-14)6-16(19-13(4)21-10-27-19)23-17(18)12(3)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
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n/an/a 98n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM438750
PNG
(21-isopropyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7...)
Show SMILES CC(C)n1nc(C)c2nc-3cc(NCc4nccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H27N7O2/c1-15(2)31-22-19-13-18(29-21(22)16(3)30-31)17-7-6-8-26-23(17)32-11-4-5-12-33-24-20(14-28-19)25-9-10-27-24/h6-10,13,15,28H,4-5,11-12,14H2,1-3H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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n/an/a 100n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279082
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(2-methylthiazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2csc(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H24N6O2S/c1-4-30-22-17(6-5-7-23-22)18-8-19(24-9-15-12-31-14(3)25-15)21-20(26-18)13(2)27-28(21)16-10-29-11-16/h5-8,12,16H,4,9-11H2,1-3H3,(H,24,26)
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279134
PNG
(N-[[1-(difluoromethyl)pyrazol-4-yl]methyl]-5-(2-et...)
Show SMILES CCOc1ncccc1-c1cc(N(Cc2cnn(c2)C(F)F)Cc2ccc(OC)cc2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C30H33F2N7O2/c1-6-41-29-24(8-7-13-33-29)25-14-26(28-27(35-25)20(4)36-39(28)19(2)3)37(16-21-9-11-23(40-5)12-10-21)17-22-15-34-38(18-22)30(31)32/h7-15,18-19,30H,6,16-17H2,1-5H3
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279169
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ocnc1C
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-22-25(5)9-14)6-16(19-13(4)21-10-27-19)23-17(18)12(3)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279164
PNG
(1-isopropyl-3-methyl-5-(1-methyl-1H-1,2,4-triazol-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-17-14(19-7-13-8-21-25(4)9-13)6-15(18-20-10-22-26(18)5)23-16(17)12(3)24-27/h6,8-11H,7H2,1-5H3,(H,19,23)
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279132
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methyl-1,2,4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncn(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C21H24N8O2/c1-4-31-21-15(6-5-7-22-21)16-8-17(23-9-18-24-12-28(3)27-18)20-19(25-16)13(2)26-29(20)14-10-30-11-14/h5-8,12,14H,4,9-11H2,1-3H3,(H,23,25)
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n/an/a 120n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279031
PNG
(5-(1,3-dimethylpyrazol-4-yl)-1-isopropyl-3-methyl-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cn(C)nc1C
Show InChI InChI=1S/C20H26N8/c1-12(2)28-20-18(21-8-15-9-22-26(5)10-15)7-17(23-19(20)14(4)25-28)16-11-27(6)24-13(16)3/h7,9-12H,8H2,1-6H3,(H,21,23)
PDB
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n/an/a 120n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279132
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methyl-1,2,4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncn(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C21H24N8O2/c1-4-31-21-15(6-5-7-22-21)16-8-17(23-9-18-24-12-28(3)27-18)20-19(25-16)13(2)26-29(20)14-10-30-11-14/h5-8,12,14H,4,9-11H2,1-3H3,(H,23,25)
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n/an/a 120n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM425070
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(2-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ncnn2C)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C21H26N8O/c1-6-30-21-15(8-7-9-22-21)16-10-17(23-11-18-24-12-25-28(18)5)20-19(26-16)14(4)27-29(20)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,23,26)
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n/an/a 120n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279082
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(2-methylthiazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2csc(C)n2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H24N6O2S/c1-4-30-22-17(6-5-7-23-22)18-8-19(24-9-15-12-31-14(3)25-15)21-20(26-18)13(2)27-28(21)16-10-29-11-16/h5-8,12,16H,4,9-11H2,1-3H3,(H,24,26)
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n/an/a 130n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM424936
PNG
(US10512632, Example 26 | US10618913, Example S26)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)ncc2n1
Show InChI InChI=1S/C20H23N7O/c1-4-27-19-17(22-10-14-11-23-26(3)13-14)9-16(25-18(19)12-24-27)15-7-6-8-21-20(15)28-5-2/h6-9,11-13H,4-5,10H2,1-3H3,(H,22,25)
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n/an/a 140n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279164
PNG
(1-isopropyl-3-methyl-5-(1-methyl-1H-1,2,4-triazol-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-17-14(19-7-13-8-21-25(4)9-13)6-15(18-20-10-22-26(18)5)23-16(17)12(3)24-27/h6,8-11H,7H2,1-5H3,(H,19,23)
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n/an/a 160n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279138
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cnnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-18-15(19-7-13-8-21-25(4)10-13)6-14(16-9-20-24-26(16)5)22-17(18)12(3)23-27/h6,8-11H,7H2,1-5H3,(H,19,22)
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n/an/a 170n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279018
PNG
(5-(2-ethoxypyridin-3-yl)-1-ethyl-3-methyl-N-((1-me...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)nc(C)c2n1
Show InChI InChI=1S/C21H25N7O/c1-5-28-20-18(23-11-15-12-24-27(4)13-15)10-17(25-19(20)14(3)26-28)16-8-7-9-22-21(16)29-6-2/h7-10,12-13H,5-6,11H2,1-4H3,(H,23,25)
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n/an/a 170n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278999
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-3-methyl-N-[(4-...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nc(C)cs2)c2n(nc(C)c2n1)C(C)C
Show InChI InChI=1S/C22H26N6OS/c1-6-29-22-16(8-7-9-23-22)17-10-18(24-11-19-25-14(4)12-30-19)21-20(26-17)15(5)27-28(21)13(2)3/h7-10,12-13H,6,11H2,1-5H3,(H,24,26)
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n/an/a 180n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279166
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-3-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccnc2OC)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C24H26N6O3/c1-4-33-24-18(8-6-10-26-24)19-11-20(27-12-16-7-5-9-25-23(16)31-3)22-21(28-19)15(2)29-30(22)17-13-32-14-17/h5-11,17H,4,12-14H2,1-3H3,(H,27,28)
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n/an/a 190n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279166
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-3-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccnc2OC)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C24H26N6O3/c1-4-33-24-18(8-6-10-26-24)19-11-20(27-12-16-7-5-9-25-23(16)31-3)22-21(28-19)15(2)29-30(22)17-13-32-14-17/h5-11,17H,4,12-14H2,1-3H3,(H,27,28)
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n/an/a 190n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278982
PNG
(1-cyclopropyl-5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1CC1
Show InChI InChI=1S/C22H25N7O/c1-4-30-22-17(6-5-9-23-22)18-10-19(24-11-15-12-25-28(3)13-15)21-20(26-18)14(2)27-29(21)16-7-8-16/h5-6,9-10,12-13,16H,4,7-8,11H2,1-3H3,(H,24,26)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278993
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-(m-tolylmethy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccc(C)c2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C24H27N5O/c1-5-30-24-19(10-7-11-25-24)20-13-21(26-14-18-9-6-8-17(4)12-18)23-22(28-20)15-27-29(23)16(2)3/h6-13,15-16H,5,14H2,1-4H3,(H,26,28)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438748
PNG
(21-ethyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7)-py...)
Show SMILES CCn1nc(C)c2nc-3cc(NCc4cccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-3-30-22-20-14-19(28-21(22)16(2)29-30)18-9-7-11-26-24(18)32-13-5-4-12-31-23-17(15-27-20)8-6-10-25-23/h6-11,14,27H,3-5,12-13,15H2,1-2H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278984
PNG
(5-(2-ethoxypyridin-3-yl)-N-((1-methyl-1H-pyrazol-4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C1COC1
Show InChI InChI=1S/C21H23N7O2/c1-3-30-21-16(5-4-6-22-21)17-7-18(23-8-14-9-24-27(2)11-14)20-19(26-17)10-25-28(20)15-12-29-13-15/h4-7,9-11,15H,3,8,12-13H2,1-2H3,(H,23,26)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278983
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(1-methylpyrazol-4-yl)me...)
Show SMILES CCCn1ncc2nc(cc(NCc3cnn(C)c3)c12)-c1cccnc1OCC
Show InChI InChI=1S/C21H25N7O/c1-4-9-28-20-18(23-11-15-12-24-27(3)14-15)10-17(26-19(20)13-25-28)16-7-6-8-22-21(16)29-5-2/h6-8,10,12-14H,4-5,9,11H2,1-3H3,(H,23,26)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438748
PNG
(21-ethyl-23-methyl-21H-6,11-dioxa-3-aza- 2(5,7)-py...)
Show SMILES CCn1nc(C)c2nc-3cc(NCc4cccnc4OCCCCOc4ncccc-34)c12
Show InChI InChI=1S/C24H26N6O2/c1-3-30-22-20-14-19(28-21(22)16(2)29-30)18-9-7-11-26-24(18)32-13-5-4-12-31-23-17(15-27-20)8-6-10-25-23/h6-11,14,27H,3-5,12-13,15H2,1-2H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279164
PNG
(1-isopropyl-3-methyl-5-(1-methyl-1H-1,2,4-triazol-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1ncnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-17-14(19-7-13-8-21-25(4)9-13)6-15(18-20-10-22-26(18)5)23-16(17)12(3)24-27/h6,8-11H,7H2,1-5H3,(H,19,23)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM438747
PNG
(21,23-dimethyl-21H-6,11-dioxa-3-aza-2(5,7)- pyrazo...)
Show SMILES Cc1nn(C)c2c3NCc4cccnc4OCCCCOc4ncccc4-c(c3)nc12
Show InChI InChI=1S/C23H24N6O2/c1-15-20-21(29(2)28-15)19-13-18(27-20)17-8-6-10-25-23(17)31-12-4-3-11-30-22-16(14-26-19)7-5-9-24-22/h5-10,13,26H,3-4,11-12,14H2,1-2H3
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM424936
PNG
(US10512632, Example 26 | US10618913, Example S26)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(CC)ncc2n1
Show InChI InChI=1S/C20H23N7O/c1-4-27-19-17(22-10-14-11-23-26(3)13-14)9-16(25-18(19)12-24-27)15-7-6-8-21-20(15)28-5-2/h6-9,11-13H,4-5,10H2,1-3H3,(H,22,25)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278984
PNG
(5-(2-ethoxypyridin-3-yl)-N-((1-methyl-1H-pyrazol-4...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(ncc2n1)C1COC1
Show InChI InChI=1S/C21H23N7O2/c1-3-30-21-16(5-4-6-22-21)17-7-18(23-8-14-9-24-27(2)11-14)20-19(26-17)10-25-28(20)15-12-29-13-15/h4-7,9-11,15H,3,8,12-13H2,1-2H3,(H,23,26)
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n/an/a 450n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM438747
PNG
(21,23-dimethyl-21H-6,11-dioxa-3-aza-2(5,7)- pyrazo...)
Show SMILES Cc1nn(C)c2c3NCc4cccnc4OCCCCOc4ncccc4-c(c3)nc12
Show InChI InChI=1S/C23H24N6O2/c1-15-20-21(29(2)28-15)19-13-18(27-20)17-8-6-10-25-23(17)31-12-4-3-11-30-22-16(14-26-19)7-5-9-24-22/h5-10,13,26H,3-4,11-12,14H2,1-2H3
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n/an/a 497n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279011
PNG
(N-benzyl-5-(2-ethoxy-3-pyridyl)-1-isopropyl-pyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccccc2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C23H25N5O/c1-4-29-23-18(11-8-12-24-23)19-13-20(25-14-17-9-6-5-7-10-17)22-21(27-19)15-26-28(22)16(2)3/h5-13,15-16H,4,14H2,1-3H3,(H,25,27)
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n/an/a 500n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279011
PNG
(N-benzyl-5-(2-ethoxy-3-pyridyl)-1-isopropyl-pyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccccc2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C23H25N5O/c1-4-29-23-18(11-8-12-24-23)19-13-20(25-14-17-9-6-5-7-10-17)22-21(27-19)15-26-28(22)16(2)3/h5-13,15-16H,4,14H2,1-3H3,(H,25,27)
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H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278998
PNG
(5-(2-ethoxy-3-pyridyl)-1,3-dimethyl-N-[(1-methylpy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(C)nc(C)c2n1
Show InChI InChI=1S/C20H23N7O/c1-5-28-20-15(7-6-8-21-20)16-9-17(22-10-14-11-23-26(3)12-14)19-18(24-16)13(2)25-27(19)4/h6-9,11-12H,5,10H2,1-4H3,(H,22,24)
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n/an/a 550n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279031
PNG
(5-(1,3-dimethylpyrazol-4-yl)-1-isopropyl-3-methyl-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cn(C)nc1C
Show InChI InChI=1S/C20H26N8/c1-12(2)28-20-18(21-8-15-9-22-26(5)10-15)7-17(23-19(20)14(4)25-28)16-11-27(6)24-13(16)3/h7,9-12H,8H2,1-6H3,(H,21,23)
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n/an/a 550n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279138
PNG
(1-isopropyl-3-methyl-N-[(1-methylpyrazol-4-yl)meth...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cnnn1C
Show InChI InChI=1S/C18H23N9/c1-11(2)27-18-15(19-7-13-8-21-25(4)10-13)6-14(16-9-20-24-26(16)5)22-17(18)12(3)23-27/h6,8-11H,7H2,1-5H3,(H,19,22)
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n/an/a 610n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279031
PNG
(5-(1,3-dimethylpyrazol-4-yl)-1-isopropyl-3-methyl-...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1cn(C)nc1C
Show InChI InChI=1S/C20H26N8/c1-12(2)28-20-18(21-8-15-9-22-26(5)10-15)7-17(23-19(20)14(4)25-28)16-11-27(6)24-13(16)3/h7,9-12H,8H2,1-6H3,(H,21,23)
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n/an/a 680n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278982
PNG
(1-cyclopropyl-5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1CC1
Show InChI InChI=1S/C22H25N7O/c1-4-30-22-17(6-5-9-23-22)18-10-19(24-11-15-12-25-28(3)13-15)21-20(26-18)14(2)27-29(21)16-7-8-16/h5-6,9-10,12-13,16H,4,7-8,11H2,1-3H3,(H,24,26)
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n/an/a 690n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM278987
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-[(1-methylimi...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nccn2C)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C21H25N7O/c1-5-29-21-15(7-6-8-23-21)16-11-17(24-13-19-22-9-10-27(19)4)20-18(26-16)12-25-28(20)14(2)3/h6-12,14H,5,13H2,1-4H3,(H,24,26)
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n/an/a 700n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278993
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-(m-tolylmethy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cccc(C)c2)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C24H27N5O/c1-5-30-24-19(10-7-11-25-24)20-13-21(26-14-18-9-6-8-17(4)12-18)23-22(28-20)15-27-29(23)16(2)3/h6-13,15-16H,5,14H2,1-4H3,(H,26,28)
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n/an/a 750n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278987
PNG
(5-(2-ethoxy-3-pyridyl)-1-isopropyl-N-[(1-methylimi...)
Show SMILES CCOc1ncccc1-c1cc(NCc2nccn2C)c2n(ncc2n1)C(C)C
Show InChI InChI=1S/C21H25N7O/c1-5-29-21-15(7-6-8-23-21)16-11-17(24-13-19-22-9-10-27(19)4)20-18(26-16)12-25-28(20)14(2)3/h6-12,14H,5,13H2,1-4H3,(H,24,26)
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n/an/a 970n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM278998
PNG
(5-(2-ethoxy-3-pyridyl)-1,3-dimethyl-N-[(1-methylpy...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(C)nc(C)c2n1
Show InChI InChI=1S/C20H23N7O/c1-5-28-20-15(7-6-8-21-20)16-9-17(22-10-14-11-23-26(3)12-14)19-18(24-16)13(2)25-27(19)4/h6-9,11-12H,5,10H2,1-4H3,(H,22,24)
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n/an/a 1.90E+3n/an/an/an/an/an/a



H. Lundbeck A/S

US Patent


Assay Description
PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...


US Patent US10618913 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%