Brief Information of the Compound and Protein
Compound Name
5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile
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PubChem ID
CID: 130026
SID: 15257509
Canonical SMILES
COc1ccc(CCNCCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC
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Compound Formula C27H38N2O5
Compound Structure
Protein Name
ATP-dependent translocase ABCB1
Protein Classification
Transporter
>
Primary active transporter
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ATP-binding cassette
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ABCB subfamily
Uniprot ID
P08183
Gene Name
ABCB1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000167 NIH-3T3-G185 Mus musculus (Mouse)  3
1
IC50 = 3600 nM
   TI
   LI
   LO
   TS
2
IC50 = 4900 nM
   TI
   LI
   LO
   TS
3
IC50 = 8600 nM
   TI
   LI
   LO
   TS