Brief Information of the Compound and Protein
Compound Name
3,3'-((3R,6S,9S,12S,15S,18S)-9-((1H-indol-3-yl)methyl)-3-((8S,11S,14S,17S)-14-((1H-indol-3-yl)methyl)-11-(4-aminobutyl)-18-(4-(2-aminoethoxy)phenyl)-8-(2,5-dioxo-1,4-diazepan-6-ylcarbamoyl)-11-methyl-2,10,13,16-tetraoxo-3,9,12,15-tetraazaoctadecan-17-ylcarbamoyl)-18-acetamido-12-((R)-1-hydroxyethyl)-5,8,11,14,17-pentaoxo-1-thia-4,7,10,13,16-pentaazacycloicosane-6,15-diyl)dipropanamide
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PubChem ID
CID: 155548763
Canonical SMILES
CC(=O)NCCCC[C@H](NC(=O)[C@](C)(CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(OCCN)cc1)NC(=O)[C@@H]1CSCC[C@H](NC(C)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCC(N)=O)C(=O)N1)C(=O)NC1CNC(=O)CNC1=O
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Compound Formula C76H106N20O18S
Compound Structure
Protein Name
Interleukin-23 receptor
Protein Classification
Unclassified protein
Uniprot ID
Q5VWK5
Gene Name
IL23R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000859 DB Homo sapiens (Human)  1
1
IC50 < 10 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 25 nM