BDBM239817 Roche-Dataset for PDE10A, Compound 269::US9394311, 100

SMILES Cc1cnc(c2n1nc(n2)CCc3nc(nn3C)N4CCC[C@@H]4C)C

InChI Key InChIKey=QOZXHVLVJINRFE-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 239817   

LigandChemical structure of BindingDB Monomer ID 239817BDBM239817(US9394311, 100 | Roche-Dataset for PDE10A, Compoun...)
Affinity DataIC50: 4.54nMAssay 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 (...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/28/2022
Entry Details Article
PubMed
LigandChemical structure of BindingDB Monomer ID 239817BDBM239817(US9394311, 100 | Roche-Dataset for PDE10A, Compoun...)
Affinity DataIC50: 5.5nMT: 2°CAssay 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...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2017
Entry Details
US Patent