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BDBM50019115 CHEMBL3288410

SMILES: Cc1nc(CCc2nc3cc(C)ccc3n2-c2ccccc2)n2cccnc12

InChI Key: InChIKey=VOYXDWSUNQJWTO-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50019115   
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))
BDBM50019115
PNG
(CHEMBL3288410)
Show SMILES Cc1nc(CCc2nc3cc(C)ccc3n2-c2ccccc2)n2cccnc12
Show InChI InChI=1S/C23H21N5/c1-16-9-10-20-19(15-16)26-22(28(20)18-7-4-3-5-8-18)12-11-21-25-17(2)23-24-13-6-14-27(21)23/h3-10,13-15H,11-12H2,1-2H3
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MMDB

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Article
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n/an/a 210n/an/an/an/an/an/a



Yamanouchi Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A expressed in Sf9 insect cell system assessed as inhibition of cAMP hydrolysis preincubated for 30 mins before ...


Bioorg Med Chem 22: 3515-26 (2014)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)