BDBM586953 CatS_121

SMILES COc1ccccc1C1CCN(C[C@@H](O)Cn2nc(c3CN(CCc23)S(C)(=O)=O)-c2ccc(c(SCCN3CCC(F)CC3)c2)C(F)(F)F)CC1

InChI Key InChIKey=IDJNHKRPVYATQJ-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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 586953   

TargetCathepsin S [115-331,C139S](Human)
D3R/Abbott

LigandPNGBDBM586953(CatS_121)
Affinity DataIC50: 20nMAssay Description:D3R2028More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2023
Entry Details
D3R