Brief Information of the Compound and Protein
Compound Name
4-amino-N-benzyl-2-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl-methylamino]butanamide
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Canonical SMILES
CN(CCC=C(c1sccc1C)c1sccc1C)C(CCN)C(=O)NCc1ccccc1
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Compound Formula C26H33N3OS2
Compound Structure
Protein Name
Sodium- and chloride-dependent GABA transporter 1
Protein Classification
Transporter
>
Electrochemical transporter
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SLC superfamily of solute carriers
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SLC06 neurotransmitter transporter family
Uniprot ID
P31648
Gene Name
SLC6A1
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 = 11481.54 nM
   TI
   LI
   LO
   TS
2
Ki = 24547.09 nM
   TI
   LI
   LO
   TS