Brief Information of the Compound and Protein
Compound Name
2-[(9R,12S,18S,21S,24S,27S,33S,36R,39S,45S,48R)-45-(4-aminobutyl)-9-[[(2S)-1-amino-1-oxopropan-2-yl]carbamoyl]-48-[[(2S)-2-aminopropanoyl]amino]-24-(hydroxymethyl)-27-[(4-hydroxyphenyl)methyl]-18-(1H-indol-3-ylmethyl)-21-methyl-4,11,17,20,23,26,29,32,35,38,44,47,53,56-tetradecaoxo-7,50,59-trithia-1,3,10,16,19,22,25,28,31,34,37,43,46,54-tetradecazapentacyclo[34.19.5.13,54.012,16.039,43]henhexacontan-33-yl]acetic acid
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PubChem ID
CID: 156019812
Canonical SMILES
C[C@H](N)C(=O)N[C@H]1CSCCC(=O)N2CN3CN(C2)C(=O)CCSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(N)=O)CSCCC3=O
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Compound Formula C75H106N20O21S3
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 = 2618 nM
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