Brief Information of the Compound and Protein
Compound Name
 Compound Info 
benzyl N-[(3R)-3-[[4-[(3,5-dibromophenyl)methoxy]phenyl]sulfonylamino]-4-(hydroxyamino)-4-oxobutyl]carbamate
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 PubChem ID
CID: 72714322
Canonical SMILES
ONC(=O)[C@@H](CCNC(=O)OCc1ccccc1)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1
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Compound Formula C25H25Br2N3O7S
Compound Structure
Protein Name
 Protein Info 
Disintegrin and metalloproteinase domain-containing protein 17
Protein Classification
Enzyme
>
Protease
>
Metallo protease
>
Metallo protease MAM clan
>
Metallo protease M12B subfamily
Uniprot ID
P78536
Gene Name
ADAM17
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000476 A2774
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 1391 nM
   TI
   LI
   LO
   TS
2
IC50 > 10000 nM
   TI
   LI
   LO
   TS
CL000072 A2780
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 825 nM
   TI
   LI
   LO
   TS
2
IC50 > 10000 nM
   TI
   LI
   LO
   TS
CL000084 SK-OV-3
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 2096 nM
   TI
   LI
   LO
   TS
2
IC50 = 9519 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 43 nM