BDBM226971 US9328096, 659

SMILES COCCN(C)CCn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@](C)(N)C4CCCC4)cc3)cc21

InChI Key InChIKey=KNNMRCWHWXOIFK-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 226971   

TargetDipeptidyl peptidase 1(Human)
Broad Institute

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 226971BDBM226971(US20260008758, Compound 258B)
Affinity DataIC50: 5nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2026
Entry Details
US Patent