BDBM114781 6-[methyl-[1- [5-(trifluoro- methoxy) pyrimidin-2- yl]propyl]amino]- 4-oxo-1-[1- [6-(trifluoro- methyl)-3- pyridyl]ethyl]- 5H-pyrazolo[3,4-d]pyrimidine-3-carbonitrile::US20260001888, Example 59

SMILES CCC(c1ncc(OC(F)(F)F)cn1)N(C)c1nc2c(c(C#N)nn2C(C)c2ccc(C(F)(F)F)nc2)c(=O)[nH]1

InChI Key InChIKey=PAHDTWXLOVMLFA-UHFFFAOYSA-N

Data  1 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 114781   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 114781BDBM114781(6-[methyl-[1- [5-(trifluoro- methoxy) pyrimidin-2-...)
Affinity DataKi:  12.1nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/13/2026
Entry Details
US Patent