Brief Information of the Compound and Protein
Compound Name
(S)-N1-((3R,6S,9S,12S,15S,18S,30R)-9-((1H-indol-3-yl)methyl)-34-amino-15-(4-aminobutyl)-18-benzyl-30-carbamoyl-12-(3-guanidinopropyl)-6-(4-hydroxybenzyl)-2-mercapto-2-methyl-4,7,10,13,16,19,22,28-octaoxo-26-oxa-5,8,11,14,17,20,23,29-octaazatetratriacontan-3-yl)-2-((2S,5S,8S,11R)-2-((1H-indol-3-yl)methyl)-8-(3-guanidinopropyl)-5-((R)-1-hydroxyethyl)-11-(2-mercaptopropan-2-yl)-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecanamido)pentanediamide
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PubChem ID
CID: 155538951
Canonical SMILES
CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCCOCC(=O)N[C@H](CCCCN)C(N)=O)C(C)(C)S)[C@@H](C)O)C(C)(C)S
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Compound Formula C91H134N26O19S2
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 = 25 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 100 nM