BindingDB logo
myBDB logout

null

SMILES: COc1ccc(cc1)-n1c(CCN(C(C)=O)C(C)=O)nc2c(Cl)cccc2c1=O

InChI Key: InChIKey=HNGZKBLENRCVOS-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 1 hit for monomerid = 50125992   
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))
BDBM50125992
PNG
(CHEMBL3627811)
Show SMILES COc1ccc(cc1)-n1c(CCN(C(C)=O)C(C)=O)nc2c(Cl)cccc2c1=O
Show InChI InChI=1S/C21H20ClN3O4/c1-13(26)24(14(2)27)12-11-19-23-20-17(5-4-6-18(20)22)21(28)25(19)15-7-9-16(29-3)10-8-15/h4-10H,11-12H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of PDE10A (unknown origin)


Bioorg Med Chem Lett 25: 4893-8 (2015)


BindingDB Entry DOI: 10.7270/Q2RJ4M9Z
More data for this
Ligand-Target Pair