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BDBM279038 3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5-yl)methyl]-5-(2-propoxy-3-pyridyl)pyrazolo[4,3-b]pyridin-7-amine,enantiomer 2::US10034861, Example 68::US10512632, Example 68::US10766893, Example S68::US10806718, Example 68

SMILES: CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC

InChI Key: InChIKey=DGDYHVXCROBNNK-UHFFFAOYSA-N

Data: 12 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 279038   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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 1A


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 0.790n/an/an/an/a7.625



H. Lundbeck A/S

US Patent


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


US Patent US10034861 (2018)


BindingDB Entry DOI: 10.7270/Q2X350HN
More data for this
Ligand-Target Pair
Phosphodiesterase, PDE1/PDE5


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 0.140n/an/an/an/a7.625



H. Lundbeck A/S

US Patent


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


US Patent US10034861 (2018)


BindingDB Entry DOI: 10.7270/Q2X350HN
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 1.30n/an/an/an/a7.625



H. Lundbeck A/S

US Patent


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


US Patent US10034861 (2018)


BindingDB Entry DOI: 10.7270/Q2X350HN
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic phosphodiesterase 1A


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 0.790n/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 was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...


US Patent US10512632 (2019)


BindingDB Entry DOI: 10.7270/Q25T3NVN
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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H. Lundbeck A/S

US Patent


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


US Patent US10512632 (2019)


BindingDB Entry DOI: 10.7270/Q25T3NVN
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 1.30n/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 was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...


US Patent US10806718 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 0.790n/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 US10766893 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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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 US10766893 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 1.30n/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 US10766893 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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n/an/a 0.790n/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 was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...


US Patent US10806718 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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H. Lundbeck A/S

US Patent


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


US Patent US10806718 (2020)

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


(Homo sapiens (Human))
BDBM279038
PNG
(3-methyl-1-[1-methylpropyl]-N-[(2-methyltetrazol-5...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2nnn(C)n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C22H29N9O/c1-6-11-32-22-16(9-8-10-23-22)17-12-18(24-13-19-26-29-30(5)28-19)21-20(25-17)15(4)27-31(21)14(3)7-2/h8-10,12,14H,6-7,11,13H2,1-5H3,(H,24,25)
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H. Lundbeck A/S

US Patent


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


US Patent US10512632 (2019)


BindingDB Entry DOI: 10.7270/Q25T3NVN
More data for this
Ligand-Target Pair