BindingDB logo
myBDB logout

BDBM156261 US9018217, 2-(1-Cyclopropylmethyl-4-phenyl-1H-imidazol-2-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine::US9592230, 2-(1-Cyclopropylmethyl-4-phenyl-1H-imidazol-2-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine

SMILES: Cc1cc(C)n2nc(SCc3nc(cn3CC3CC3)-c3ccccc3)nc2c1

InChI Key: InChIKey=MXENMLTZFIQGGM-UHFFFAOYSA-N

Data: 2 IC50

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 = 156261   
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))
BDBM156261
PNG
(US9018217, 2-(1-Cyclopropylmethyl-4-phenyl-1H-imid...)
Show SMILES Cc1cc(C)n2nc(SCc3nc(cn3CC3CC3)-c3ccccc3)nc2c1
Show InChI InChI=1S/C22H23N5S/c1-15-10-16(2)27-20(11-15)24-22(25-27)28-14-21-23-19(18-6-4-3-5-7-18)13-26(21)12-17-8-9-17/h3-7,10-11,13,17H,8-9,12,14H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

US Patent
n/an/a 34n/an/an/an/an/an/a



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 US9592230 (2017)


BindingDB Entry DOI: 10.7270/Q2CV4KSH
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM156261
PNG
(US9018217, 2-(1-Cyclopropylmethyl-4-phenyl-1H-imid...)
Show SMILES Cc1cc(C)n2nc(SCc3nc(cn3CC3CC3)-c3ccccc3)nc2c1
Show InChI InChI=1S/C22H23N5S/c1-15-10-16(2)27-20(11-15)24-22(25-27)28-14-21-23-19(18-6-4-3-5-7-18)13-26(21)12-17-8-9-17/h3-7,10-11,13,17H,8-9,12,14H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

US Patent
n/an/a 34n/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 US9018217 (2015)


BindingDB Entry DOI: 10.7270/Q2KW5DS1
More data for this
Ligand-Target Pair