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BDBM279171 1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)methyl)-5-(4-methyloxazol-2-yl)-1H-pyrazolo[4,3-b]pyridin-7-amine::US10034861, Example 202

SMILES: CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nc(C)co1

InChI Key: InChIKey=GNUZZRWHGHQDMA-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 = 279171   
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))
BDBM279171
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nc(C)co1
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-21-25(5)9-14)6-16(19-22-12(3)10-27-19)23-17(18)13(4)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 92n/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))
BDBM279171
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nc(C)co1
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-21-25(5)9-14)6-16(19-22-12(3)10-27-19)23-17(18)13(4)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
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))
BDBM279171
PNG
(1-isopropyl-3-methyl-N-((1-methyl-1H-pyrazol-4-yl)...)
Show SMILES CC(C)n1nc(C)c2nc(cc(NCc3cnn(C)c3)c12)-c1nc(C)co1
Show InChI InChI=1S/C19H23N7O/c1-11(2)26-18-15(20-7-14-8-21-25(5)9-14)6-16(19-22-12(3)10-27-19)23-17(18)13(4)24-26/h6,8-11H,7H2,1-5H3,(H,20,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14n/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