Brief Information of the Compound and Protein
Compound Name
 Compound Info 
CAS_52-53-9
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 PubChem ID
CID: 2520
SID: 14784349
Canonical SMILES
COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC
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Compound Formula C27H38N2O4
Compound Structure
Protein Name
 Protein Info 
Broad substrate specificity ATP-binding cassette transporter ABCG2
Protein Classification
Transporter
>
Primary active transporter
>
ATP-binding cassette
>
ABCG subfamily
Uniprot ID
Q9UNQ0
Gene Name
ABCG2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000031 MDCK
 Cell Line Info 
Canis lupus familiaris (Dog)  1
1
EC50 = 900 nM
   TI
   LI
   LO
   TS
CL000360 MES-SA
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 37300 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 > 50000 nM
   TI
   LI
   LO
   TS