Brief Information of the Compound and Protein
Compound Name
CAS_136434-34-9
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PubChem ID
CID: 60835
SID: 14873633
Canonical SMILES
CNCC[C@H](Oc1cccc2ccccc12)c1cccs1
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Compound Formula C18H19NOS
Compound Structure
Protein Name
Sodium-dependent serotonin transporter
Protein Classification
Transporter
>
Electrochemical transporter
>
SLC superfamily of solute carriers
>
SLC06 neurotransmitter transporter family
Uniprot ID
P31645
Gene Name
SLC6A4
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)  8
1
IC50 = 0.3162 nM
   TI
   LI
   LO
   TS
2
IC50 = 2.3 nM
   TI
   LI
   LO
   TS
3
IC50 = 4 nM
   TI
   LI
   LO
   TS
4
IC50 = 6 nM
   TI
   LI
   LO
   TS
5
IC50 = 6.6 nM
   TI
   LI
   LO
   TS
6
IC50 = 10.4 nM
   TI
   LI
   LO
   TS
7
Ki = 0.24 nM
   TI
   LI
   LO
   TS
8
Ki = 5 nM
   TI
   LI
   LO
   TS
CL000232 JAR Homo sapiens (Human)  1
1
IC50 = 3 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 6.6 nM
2 Ki = 0.5012 nM
3 Ki = 0.79 nM
4 Ki = 0.8 nM
5 Ki = 4.6 nM