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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A' and Ligand = 'BDBM156255'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM156255
PNG
(US9018217, 5,7-Dimethyl-2-[1-(3-methyl-butyl)-4-ph...)
Show SMILES CC(C)CCn1cc(nc1SCc1cn2c(C)cc(C)nc2n1)-c1ccccc1
Show InChI InChI=1S/C23H27N5S/c1-16(2)10-11-27-14-21(19-8-6-5-7-9-19)26-23(27)29-15-20-13-28-18(4)12-17(3)24-22(28)25-20/h5-9,12-14,16H,10-11,15H2,1-4H3
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MMDB

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5.40n/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))
BDBM156255
PNG
(US9018217, 5,7-Dimethyl-2-[1-(3-methyl-butyl)-4-ph...)
Show SMILES CC(C)CCn1cc(nc1SCc1cn2c(C)cc(C)nc2n1)-c1ccccc1
Show InChI InChI=1S/C23H27N5S/c1-16(2)10-11-27-14-21(19-8-6-5-7-9-19)26-23(27)29-15-20-13-28-18(4)12-17(3)24-22(28)25-20/h5-9,12-14,16H,10-11,15H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 5.40n/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