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BDBM362560 US10562916, Compound 120::US9834564, Compound 120

SMILES: C(Oc1cnc2ccccc2n1)c1nc(c[nH]1)-c1ccccc1

InChI Key: InChIKey=NXBCETFGYMWKDH-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 362560   
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
3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM362560
PNG
(US10562916, Compound 120 | US9834564, Compound 120)
Show SMILES C(Oc1cnc2ccccc2n1)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C18H14N4O/c1-2-6-13(7-3-1)16-10-20-17(21-16)12-23-18-11-19-14-8-4-5-9-15(14)22-18/h1-11H,12H2,(H,20,21)
PDB
MMDB

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US Patent
n/an/a<500n/an/an/an/an/an/a



Sunovion Pharmaceuticals, Inc.

US Patent


Assay Description
In one embodiment, the compounds provided herein were assayed for their ability to inhibit human PDE-10A. In one embodiment, the activities of the co...


US Patent US10562916 (2020)


BindingDB Entry DOI: 10.7270/Q2N87D6K
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM362560
PNG
(US10562916, Compound 120 | US9834564, Compound 120)
Show SMILES C(Oc1cnc2ccccc2n1)c1nc(c[nH]1)-c1ccccc1
Show InChI InChI=1S/C18H14N4O/c1-2-6-13(7-3-1)16-10-20-17(21-16)12-23-18-11-19-14-8-4-5-9-15(14)22-18/h1-11H,12H2,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Sunovion Pharmaceuticals Inc.

US Patent


Assay Description
The activities of the compounds were determined using the Molecular Devices IMAP PDE Fluorescence Polarization assay using recombinant human PDE-10 e...


US Patent US9834564 (2017)


BindingDB Entry DOI: 10.7270/Q2FF3VN4
More data for this
Ligand-Target Pair