Brief Information of the Compound and Protein
Compound Name
2-[(7R,10S,13S,19S,22S,25R,28S,31S,34S,37S,40S,43R)-37-(2-amino-2-oxoethyl)-7-[[(2S)-1-amino-1-oxopropan-2-yl]carbamoyl]-43-[[(2S)-2-aminopropanoyl]amino]-10-[(1R)-1-hydroxyethyl]-22-(hydroxymethyl)-13,31-bis(1H-indol-3-ylmethyl)-19,28-bis(2-methylpropyl)-40-(2-methylsulfanylethyl)-9,12,15,18,21,24,27,30,33,36,39,42-dodecaoxo-5,45,50-trithia-8,11,14,17,20,23,26,29,32,35,38,41-dodecazatricyclo[23.23.3.13,47]dopentaconta-1(48),2,47(52)-trien-34-yl]acetic acid
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PubChem ID
CID: 156021249
Canonical SMILES
CSCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](C)N)CSCc2cc3cc(c2)CSC[C@@H](C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2c[nH]c4ccccc24)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CSC3)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC1=O
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Compound Formula C80H111N19O20S4
Compound Structure
Protein Name
Ephrin type-A receptor 2
Protein Classification
Enzyme
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Kinase
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Protein Kinase
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TK protein kinase group
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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 = 101 nM
   TI
   LI
   LO
   TS