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SMILES: Cc1cc(C)n2cc(CCc3nc(cn3C)-c3ccccc3)nc2n1

InChI Key: InChIKey=CKTXMYVIEZZKTR-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 2 hits for monomerid = 156269   
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))
BDBM156269
PNG
(US9018217, 5,7-Dimethyl-2-[2-(1-methyl-4-phenyl-1H...)
Show SMILES Cc1cc(C)n2cc(CCc3nc(cn3C)-c3ccccc3)nc2n1
Show InChI InChI=1S/C20H21N5/c1-14-11-15(2)25-12-17(22-20(25)21-14)9-10-19-23-18(13-24(19)3)16-7-5-4-6-8-16/h4-8,11-13H,9-10H2,1-3H3
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 68n/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))
BDBM156269
PNG
(US9018217, 5,7-Dimethyl-2-[2-(1-methyl-4-phenyl-1H...)
Show SMILES Cc1cc(C)n2cc(CCc3nc(cn3C)-c3ccccc3)nc2n1
Show InChI InChI=1S/C20H21N5/c1-14-11-15(2)25-12-17(22-20(25)21-14)9-10-19-23-18(13-24(19)3)16-7-5-4-6-8-16/h4-8,11-13H,9-10H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 68n/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