Brief Information of the Compound and Protein
Compound Name
N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-4,5-dimethoxy-2-nitrobenzamide
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PubChem ID
CID: 44451888
Canonical SMILES
COc1cc2CCN(CCc3ccc(NC(=O)c4cc(OC)c(OC)cc4[N+]([O-])=O)cc3)Cc2cc1OC
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Compound Formula C28H31N3O7
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
CL000072 A2780 Homo sapiens (Human)  2
1
IC50 = 4897.79 nM
   TI
   LI
   LO
   TS
2
IC50 = 6165.95 nM
   TI
   LI
   LO
   TS
CL000135 A2780ADR Homo sapiens (Human)  1
1
IC50 = 13000 nM
   TI
   LI
   LO
   TS