Brief Information of the Compound and Protein
Compound Name
4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
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PubChem ID
CID: 5291
SID: 14859628
Canonical SMILES
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
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Compound Formula C29H31N7O
Compound Structure
Protein Name
Multidrug and toxin extrusion protein 1
Protein Classification
Transporter
>
Electrochemical transporter
>
SLC superfamily of solute carriers
>
SLC47 family of multidrug and toxin extrusion transporters
Uniprot ID
Q96FL8
Gene Name
SLC47A1
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)  2
1
IC50 = 50 nM
   TI
   LI
   LO
   TS
2
IC50 = 350 nM
   TI
   LI
   LO
   TS
CL000036 MDCK-II Canis lupus familiaris (Dog)  1
1
IC50 = 40 nM
   TI
   LI
   LO
   TS