Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-(2-(((4R,8S,11S)-11-amino-8-(4-hydroxybenzyl)-6,10-dioxo-1,2-dithia-5,9-diazacyclotridecane-4-carboxamido)methyl)phenyl)acetic acid
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 PubChem ID
CID: 49840774
SID: 111327704
Canonical SMILES
N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O
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Compound Formula C26H32N4O6S2
Compound Structure
Protein Name
 Protein Info 
Interleukin-1 receptor antagonist protein
Protein Classification
Unclassified protein
Uniprot ID
P18510
Gene Name
IL1RN
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 18 nM
   TI
   LI
   LO
   TS
2
Ki = 10.9 nM
   TI
   LI
   LO
   TS