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BDBM173174 US9096589, 4-{2-[2-(8-Methoxy-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-ethyl]-4-thiophen-2-yl-imidazol-1-yl}-butyronitrile

SMILES: COc1ccc(C)n2nc(CCc3nc(cn3CCCC#N)-c3cccs3)nc12

InChI Key: InChIKey=WTNIWJOIJQYMCT-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 173174   
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))
BDBM173174
PNG
(US9096589, 4-{2-[2-(8-Methoxy-5-methyl-[1,2,4]tria...)
Show SMILES COc1ccc(C)n2nc(CCc3nc(cn3CCCC#N)-c3cccs3)nc12
Show InChI InChI=1S/C21H22N6OS/c1-15-7-8-17(28-2)21-24-19(25-27(15)21)9-10-20-23-16(18-6-5-13-29-18)14-26(20)12-4-3-11-22/h5-8,13-14H,3-4,9-10,12H2,1-2H3
PDB
MMDB

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Similars

US Patent
n/an/a 1.70n/an/an/an/an/a25



H. Lundbeck A/S

US Patent


Assay Description
A PDE10A assay may for example, be performed as follows: The assay is performed in 60 uL samples containing a fixed amount of the relevant PDE enzyme...


US Patent US9096589 (2015)


BindingDB Entry DOI: 10.7270/Q25Q4TTM
More data for this
Ligand-Target Pair