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BDBM279104 3-methyl-1-[1-methylpropyl]-5-(2-propoxy-3-pyridyl)-N-(1H-pyrazol-3-ylmethyl)pyrazolo[4,3-b]pyridin-7-amine,enantiomer 2::US10034861, Example 135

SMILES: CCCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC

InChI Key: InChIKey=QYAONCSFRJZQFJ-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 = 279104   
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))
BDBM279104
PNG
(3-methyl-1-[1-methylpropyl]-5-(2-propoxy-3-pyridyl...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-5-12-31-23-18(8-7-10-24-23)19-13-20(25-14-17-9-11-26-28-17)22-21(27-19)16(4)29-30(22)15(3)6-2/h7-11,13,15H,5-6,12,14H2,1-4H3,(H,25,27)(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.90n/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))
BDBM279104
PNG
(3-methyl-1-[1-methylpropyl]-5-(2-propoxy-3-pyridyl...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-5-12-31-23-18(8-7-10-24-23)19-13-20(25-14-17-9-11-26-28-17)22-21(27-19)16(4)29-30(22)15(3)6-2/h7-11,13,15H,5-6,12,14H2,1-4H3,(H,25,27)(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.60n/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
Phosphodiesterase, PDE1/PDE5


(Homo sapiens (Human))
BDBM279104
PNG
(3-methyl-1-[1-methylpropyl]-5-(2-propoxy-3-pyridyl...)
Show SMILES CCCOc1ncccc1-c1cc(NCc2cc[nH]n2)c2n(nc(C)c2n1)C(C)CC
Show InChI InChI=1S/C23H29N7O/c1-5-12-31-23-18(8-7-10-24-23)19-13-20(25-14-17-9-11-26-28-17)22-21(27-19)16(4)29-30(22)15(3)6-2/h7-11,13,15H,5-6,12,14H2,1-4H3,(H,25,27)(H,26,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.0950n/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