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SMILES: Cc1nc(C)n(n1)-c1cc(nc(C)n1)C1CC1c1nc2ccccn2c1C

InChI Key: InChIKey=WGHDYOHZXVHSJS-UHFFFAOYSA-N

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 = 50530442   
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
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50530442
PNG
(CHEMBL4461114)
Show SMILES Cc1nc(C)n(n1)-c1cc(nc(C)n1)C1CC1c1nc2ccccn2c1C
Show InChI InChI=1S/C20H21N7/c1-11-20(24-18-7-5-6-8-26(11)18)16-9-15(16)17-10-19(23-12(2)22-17)27-14(4)21-13(3)25-27/h5-8,10,15-16H,9H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Inhibition of human PDE10


Eur J Med Chem 181: (2019)


Article DOI: 10.1016/j.ejmech.2019.111569
BindingDB Entry DOI: 10.7270/Q2H41VXG
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50530442
PNG
(CHEMBL4461114)
Show SMILES Cc1nc(C)n(n1)-c1cc(nc(C)n1)C1CC1c1nc2ccccn2c1C
Show InChI InChI=1S/C20H21N7/c1-11-20(24-18-7-5-6-8-26(11)18)16-9-15(16)17-10-19(23-12(2)22-17)27-14(4)21-13(3)25-27/h5-8,10,15-16H,9H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Inhibition of human PDE10


Eur J Med Chem 181: (2019)


Article DOI: 10.1016/j.ejmech.2019.111569
BindingDB Entry DOI: 10.7270/Q2H41VXG
More data for this
Ligand-Target Pair