Brief Information of the Compound and Protein
Compound Name
 Compound Info 
[(2R)-1-[[4-[[3-(cyclopropylsulfonylmethyl)phenoxy]methyl]phenyl]methyl]pyrrolidin-2-yl]methanol
    Show/Hide
 PubChem ID
CID: 137634221
Canonical SMILES
OC[C@H]1CCCN1Cc1ccc(COc2cccc(CS(=O)(=O)C3CC3)c2)cc1
    Show/Hide
Compound Formula C23H29NO4S
Compound Structure
Protein Name
 Protein Info 
Sphingosine kinase 1
Protein Classification
Enzyme
Uniprot ID
Q9NYA1
Gene Name
SPHK1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000980 MDA-1483
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 1.7 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 10 nM
   TI
   LI
   LO
   TS
2
IC50 = 40.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1470 nM