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BDBM50357878 CHEMBL1916138

SMILES: Cc1nc(-c2ccncc2C)n2c1c(C)nc1c(F)cc(OCC3CC3)cc21

InChI Key: InChIKey=GEVPWAZNJXIORL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50357878   
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))
BDBM50357878
PNG
(CHEMBL1916138)
Show SMILES Cc1nc(-c2ccncc2C)n2c1c(C)nc1c(F)cc(OCC3CC3)cc21
Show InChI InChI=1S/C22H21FN4O/c1-12-10-24-7-6-17(12)22-26-14(3)21-13(2)25-20-18(23)8-16(9-19(20)27(21)22)28-11-15-4-5-15/h6-10,15H,4-5,11H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.70n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged human PDE10A expressed in Escherichia coli using [3H]cAMP after 1 hr by scintillation proximity assay


J Med Chem 54: 7621-38 (2011)


Article DOI: 10.1021/jm2009138
BindingDB Entry DOI: 10.7270/Q2125T2B
More data for this
Ligand-Target Pair
Homo sapiens phosphodiesterase 2A (PDE2A)


(Homo sapiens (Human))
BDBM50357878
PNG
(CHEMBL1916138)
Show SMILES Cc1nc(-c2ccncc2C)n2c1c(C)nc1c(F)cc(OCC3CC3)cc21
Show InChI InChI=1S/C22H21FN4O/c1-12-10-24-7-6-17(12)22-26-14(3)21-13(2)25-20-18(23)8-16(9-19(20)27(21)22)28-11-15-4-5-15/h6-10,15H,4-5,11H2,1-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 81n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PDE2A using [3H]cAMP after 1 hr by scintillation proximity assay


J Med Chem 54: 7621-38 (2011)


Article DOI: 10.1021/jm2009138
BindingDB Entry DOI: 10.7270/Q2125T2B
More data for this
Ligand-Target Pair