BDBM50257015 (4S)-4-{2-[3-(4-Chloro-2-trifluoromethyl-phenylcarbamoyloxymethyl)-(3R)-2-oxo-5-phenyl-2,3-dihydro-benzo[e][1,4]diazepin-1-yl]-acetylamino}-6-phenyl-hex-2-enoic acid methyl ester::CHEMBL453473

SMILES COC(=O)/C=C/[C@H](CCc1ccccc1)NC(=O)CN1C(=O)[C@@H](COC(=O)Nc2ccc(Cl)cc2C(F)(F)F)N=C(c2ccccc2)c2ccccc21

InChI Key InChIKey=ZSTUCVJIVAHYMQ-UHFFFAOYSA-N

Data  2 KI

  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 2 hits for monomerid = 50257015   

TargetProcathepsin L(Human)
University of Messina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50257015BDBM50257015((4S)-4-{2-[3-(4-Chloro-2-trifluoromethyl-phenylcar...)
Affinity DataKi:  2.70E+3nMAssay Description:Inhibition of cathepsin LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCathepsin B(Human)
University of Messina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50257015BDBM50257015((4S)-4-{2-[3-(4-Chloro-2-trifluoromethyl-phenylcar...)
Affinity DataKi:  1.37E+4nMAssay Description:Inhibition of cathepsin BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed