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BDBM279095 5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)methyl]-3-methyl-1-[1-methylpropyl]pyrazolo[4,3-b]pyridin-7-amine,enantiomer 2::US10034861, Example 126

SMILES: CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC

InChI Key: InChIKey=JRNBIFGQRNWOKC-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 = 279095   
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))
BDBM279095
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
UniChem
n/an/a 5.40n/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 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))
BDBM279095
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
UniChem
n/an/a 8.40n/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 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))
BDBM279095
PNG
(5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...)
Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
UniChem
n/an/a 0.510n/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 US10034861 (2018)

More data for this
Ligand-Target Pair