BDBM502785 US11028092, Example 95

SMILES C[C@H](c1cnc(C2CC2)nc1)n1nc(C#N)c2c(=O)[nH]c([C@@H]3CC[C@H]3c3ncccn3)nc21

InChI Key InChIKey=FEPNMKDMRNRDPJ-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 502785   

TargetHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 502785BDBM502785(US11028092, Example 95)
Affinity DataKi:  1.5nMAssay Description:Assays for PDE 1 through 11 were performed in parallel at room temperature in 384-well microtiter plates with an incubation volume of 20.2 μL. S...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/29/2021
Entry Details
US Patent