Brief Information of the Compound and Protein
Compound Name
3-[(9R,12S,15S,18S,21S,24S,27R,30S,33S,39S,42S,45R)-33-(4-aminobutyl)-15-(2-amino-2-oxoethyl)-9-[[(2S)-1-amino-1-oxopropan-2-yl]carbamoyl]-45-[[(2S)-2-aminopropanoyl]amino]-21,42-bis[(4-hydroxyphenyl)methyl]-24-methyl-18-(2-methylsulfanylethyl)-4,11,14,17,20,23,26,29,32,35,38,41,44,50,53-pentadecaoxo-12,39-di(propan-2-yl)-7,47,56-trithia-1,3,10,13,16,19,22,25,28,31,34,37,40,43,51-pentadecazatricyclo[25.25.5.13,51]octapentacontan-30-yl]propanoic acid
    Show/Hide
PubChem ID
CID: 156013992
Canonical SMILES
CSCC[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC(=O)[C@@H]2CSCCC(=O)N3CN(CN(C3)C(=O)CCSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N2)C(=O)CCSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C)C(=O)N[C@@H](C)C(N)=O
    Show/Hide
Compound Formula C80H121N21O23S4
Compound Structure
Protein Name
Ephrin type-A receptor 2
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase Eph family
Uniprot ID
P29317
Gene Name
EPHA2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 210 nM
   TI
   LI
   LO
   TS