Brief Information of the Compound and Protein
Compound Name
6-methoxy-N-propan-2-yl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]-2-(trifluoromethyl)quinazolin-4-amine
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Canonical SMILES
COc1ccc2nc(nc(N(Cc3nc(no3)-c3cccnc3)C(C)C)c2c1)C(F)(F)F
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Compound Formula C21H19F3N6O2
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
CL000135 A2780ADR Homo sapiens (Human)  2
1
IC50 = 2640 nM
   TI
   LI
   LO
   TS
2
IC50 = 4530 nM
   TI
   LI
   LO
   TS