BDBM586464 CatS_3

SMILES Cn1c(=O)n(C2CCN(CCCn3nc(-c4ccc(C(F)(F)F)cc4)c4c3CCN(C(=O)c3c[nH]cn3)C4)CC2)c2ccccc21

InChI Key InChIKey=MHNXUUQVKHVSPU-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 586464   

TargetCathepsin S(Human)
D3R/Abbott

LigandChemical structure of BindingDB Monomer ID 586464BDBM586464(CatS_3)
Affinity DataIC50: 55nMAssay Description:D3R2020More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/19/2023
Entry Details
D3R