BDBM586505 CatS_102::CatS_23

SMILES C[C@H]1COCCN1CCCn1nc(c2CN(CCc12)C(=O)C(N)=O)-c1ccc(Cl)c(c1)C#Cc1ccc(Cl)c(CNCc2ccccc2)c1

InChI Key InChIKey=CIONECARUUEYBQ-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 2 hits for monomerid = 586505   

TargetCathepsin S(Human)
D3R/Abbott

LigandPNGBDBM586505(CatS_102 | CatS_23)
Affinity DataIC50: 15nMAssay Description:D3R2020More data for this Ligand-Target Pair
In DepthDetails
D3R

TargetCathepsin S(Human)
D3R/Abbott

LigandPNGBDBM586505(CatS_102 | CatS_23)
Affinity DataIC50: 15nMAssay Description:D3R2020More data for this Ligand-Target Pair
In DepthDetails
D3R