BDBM177694 US9120772, 6

SMILES Cc1cc2c(c(C)c1O[C@H](c1ccncc1)c1ccc(C#N)cc1)OCCC2=O

InChI Key InChIKey=ZMIYRIGYJBURQV-UHFFFAOYSA-N

Data  2 IC50

  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 = 177694   

TargetHLA-DR4 protein(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 177694BDBM177694((*S)-4-(((6,8-dimethyl-4-oxochroman-7-yl)oxy)(pyri...)
Affinity DataIC50: 360nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/18/2026
Entry Details
US Patent