Brief Information of the Compound and Protein
Compound Name
 Compound Info 
{(S)-1-[(1S,2R)-1-Benzyl-2-hydroxy-2-((10S,13R)-10-isopropyl-9,12-dioxo-2,5-dioxa-8,11,14-triaza-bicyclo[14.2.2]icosa-1(19),16(20),17-trien-13-yl)-ethylcarbamoyl]-2,2-dimethyl-propyl}-carbamic acid benzyl ester
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 PubChem ID
CID: 461294
SID: 15459859
Canonical SMILES
CC(C)[C@@H]1NC(=O)[C@@H]([C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)NCc2ccc(cc2)OCCOCCNC1=O
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Compound Formula C41H55N5O8
Compound Structure
Protein Name
 Protein Info 
Protease
Protein Classification
Enzyme
>
Protease
>
Cysteine protease
>
Cysteine protease PAC clan
>
Cysteine protease C3A subfamily
Uniprot ID
Q4U254
Gene Name
PROTEASE
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000247 MT-4
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 53 nM
   TI
   LI
   LO
   TS
2
Ki = 16 nM
   TI
   LI
   LO
   TS