Brief Information of the Compound and Protein
Compound Name
1-(2-chlorophenyl)-N-methyl-N-(1-methylpropyl)isoquinoline-3-carboxamide
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PubChem ID
CID: 1345
SID: 14900970
Canonical SMILES
CCC(C)N(C)C(=O)c1cc2ccccc2c(n1)-c1ccccc1Cl
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Compound Formula C21H21ClN2O
Compound Structure
Protein Name
Translocator protein
Protein Classification
Membrane receptor
Uniprot ID
P30536
Gene Name
TSPO
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  2
1
Ki = 29.2 nM
   TI
   LI
   LO
   TS
2
Ki = 36 nM
   TI
   LI
   LO
   TS
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 36 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Activity = 0.63 nM
2 IC50 = 1.1 nM
3 IC50 = 2.5 nM
4 IC50 = 490 nM
5 Kd = 2 nM
6 Kd = 11.1 nM
7 Ki = 2.3 nM
8 Ki = 4.5 nM
9 Ki = 7.11 nM