Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-hydroxy-2-naphthoic acid;4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]-2-methylol-phenol
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 PubChem ID
CID: 5152
SID: 14904552
Canonical SMILES
OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1
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Compound Formula C25H37NO4
Compound Structure
Protein Name
 Protein Info 
Beta-1 adrenergic receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Monoamine receptor
>
Adrenergic receptor
Uniprot ID
P08588
Gene Name
ADRB1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  2
1
EC50 = 794.33 nM
   TI
   LI
   LO
   TS
2
Ki = 784 nM
   TI
   LI
   LO
   TS
CL000053 COS-7
 Cell Line Info 
Chlorocebus aethiops (Green monkey)  1
1
Ki = 2300 nM
   TI
   LI
   LO
   TS
CL000025 HEK-293T
 Cell Line Info 
Homo sapiens (Human)  2
1
EC50 = 199.53 nM
   TI
   LI
   LO
   TS
2
EC50 = 5011.87 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  3
1
EC50 = 316.23 nM
   TI
   LI
   LO
   TS
2
EC50 = 371.54 nM
   TI
   LI
   LO
   TS
3
EC50 = 1230.27 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 501.19 nM
2 Ki = 801 nM