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Found 2 hits Enz. Inhib. hit(s) with Target = 'cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A' and Ligand = 'BDBM239840'   
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))
BDBM239840
PNG
(Roche-Dataset for PDE10A, Compound 47 | US9394311,...)
Show SMILES Cc1c(Cl)cc(c2nc(CCc3nc(nn3C3CCOCC3)N3CCCC3)nn12)C(F)(F)F
Show InChI InChI=1S/C21H25ClF3N7O/c1-13-16(22)12-15(21(23,24)25)19-26-17(28-31(13)19)4-5-18-27-20(30-8-2-3-9-30)29-32(18)14-6-10-33-11-7-14/h12,14H,2-11H2,1H3
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.350n/an/an/an/an/an/a


TBA

Assay Description
Human PDE10A IC50 values were determined by using purified enzyme (Biomol cat. # SE-534) in a scintillation proximity assay (SPA) in 96 well plates (...


Citation and Details

Article DOI: 10.1007/s10822-022-00478-x
BindingDB Entry DOI: 10.7270/Q29W0JQD
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM239840
PNG
(Roche-Dataset for PDE10A, Compound 47 | US9394311,...)
Show SMILES Cc1c(Cl)cc(c2nc(CCc3nc(nn3C3CCOCC3)N3CCCC3)nn12)C(F)(F)F
Show InChI InChI=1S/C21H25ClF3N7O/c1-13-16(22)12-15(21(23,24)25)19-26-17(28-31(13)19)4-5-18-27-20(30-8-2-3-9-30)29-32(18)14-6-10-33-11-7-14/h12,14H,2-11H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.350n/an/an/an/an/a25



Hoffmann-La Roche Inc.

US Patent


Assay Description
The human PDE10A full length assay was performed in 96-well micro titer plates. The reaction mixture of 50 μl contained 20 mM HEPES pH=7.5/10 mM M...


US Patent US9394311 (2016)


BindingDB Entry DOI: 10.7270/Q27D2T2H
More data for this
Ligand-Target Pair