Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-[2-[[[(2S,6S,13S)-13-amino-2-[(4-hydroxyphenyl)methyl]-4,9,14-trioxo-1,5,10-triazacyclotetradecane-6-carbonyl]amino]methyl]phenyl]acetic acid
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Canonical SMILES
N[C@H]1CCNC(=O)CC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O
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Compound Formula C28H35N5O7
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 = 1460 nM
   TI
   LI
   LO
   TS
2
Ki = 887 nM
   TI
   LI
   LO
   TS