BindingDB logo
myBDB logout

BDBM278997 5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1-(oxetan-3-yl)pyrazolo[4,3-b]pyridin-7-amine::US10034861, Example 27

SMILES: CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1COC1

InChI Key: InChIKey=HKTCICUQHUTDJM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 278997   
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
Phosphodiesterase 1A (PDE1A)


(Homo sapiens (Human))
BDBM278997
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methylpyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H25N7O2/c1-4-31-22-17(6-5-7-23-22)18-8-19(24-9-15-10-25-28(3)11-15)21-20(26-18)14(2)27-29(21)16-12-30-13-16/h5-8,10-11,16H,4,9,12-13H2,1-3H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 94n/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)

More data for this
Ligand-Target Pair
Phosphodiesterase 1C (PDE1C)


(Homo sapiens (Human))
BDBM278997
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methylpyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H25N7O2/c1-4-31-22-17(6-5-7-23-22)18-8-19(24-9-15-10-25-28(3)11-15)21-20(26-18)14(2)27-29(21)16-12-30-13-16/h5-8,10-11,16H,4,9,12-13H2,1-3H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 170n/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)

More data for this
Ligand-Target Pair
Phosphodiesterase, PDE1/PDE5


(Homo sapiens (human))
BDBM278997
PNG
(5-(2-ethoxy-3-pyridyl)-3-methyl-N-[(1-methylpyrazo...)
Show SMILES CCOc1ncccc1-c1cc(NCc2cnn(C)c2)c2n(nc(C)c2n1)C1COC1
Show InChI InChI=1S/C22H25N7O2/c1-4-31-22-17(6-5-7-23-22)18-8-19(24-9-15-10-25-28(3)11-15)21-20(26-18)14(2)27-29(21)16-12-30-13-16/h5-8,10-11,16H,4,9,12-13H2,1-3H3,(H,24,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.60n/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)

More data for this
Ligand-Target Pair