BDBM586558 CatS_76

SMILES CN(Cc1ccc(Cl)cc1)Cc1ccc(cc1)C#Cc1cc(ccc1Cl)-c1nn(CCCN2CCN(CC2)c2ccccc2)c2CCN(Cc12)S(C)(=O)=O

InChI Key InChIKey=AOJRIPLRRRUUBC-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 586558   

TargetCathepsin S(Human)
D3R/Abbott

LigandPNGBDBM586558(CatS_76)
Affinity DataIC50: 72nMAssay Description:D3R2020More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2023
Entry Details
D3R