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PDB code 5EDH

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
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

  (313/313 = 100%)
(Homo sapiens (Human))
BDBM239792
PNG
(US9394311, 75)
Show SMILES CCc1cnc(C)n2nc(CCc3nc(nn3C)N3CCCC3)nc12
Show InChI InChI=1S/C17H24N8/c1-4-13-11-18-12(2)25-16(13)19-14(21-25)7-8-15-20-17(22-23(15)3)24-9-5-6-10-24/h11H,4-10H2,1-3H3
PDB
MMDB

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DrugBank
GoogleScholar
PC cid
PC sid
PDB
UniChem
PDB
US Patent
n/an/a 3.78n/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
3D
3D Structure (crystal)

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* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output