Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSphingosine kinase 1
LigandBDBM50237425
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1660109 (CHEMBL4009721)
IC50 48000±n/a nM
Citation Schnute, MEMcReynolds, MDCarroll, JChrencik, JHighkin, MKIyanar, KJerome, GRains, JWSaabye, MScholten, JAYates, MNagiec, MM Discovery of a Potent and Selective Sphingosine Kinase 1 Inhibitor through the Molecular Combination of Chemotype-Distinct Screening Hits. J Med Chem60:2562-2572 (2017) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Sphingosine kinase 1
Name:Sphingosine kinase 1
Synonyms:SK1 | SPHK | SPHK1 | SPHK1_HUMAN | SPK | Sphingosine kinase 1 | Sphingosine kinase 1 (SPHK1) | Sphingosine kinase types 1 (SphK1)
Type:Enzyme
Mol. Mass.:42521.16
Organism:Homo sapiens (Human)
Description:Q9NYA1
Residue:384
Sequence:
MDPAGGPRGVLPRPCRVLVLLNPRGGKGKALQLFRSHVQPLLAEAEISFTLMLTERRNHA
RELVRSEELGRWDALVVMSGDGLMHEVVNGLMERPDWETAIQKPLCSLPAGSGNALAASL
NHYAGYEQVTNEDLLTNCTLLLCRRLLSPMNLLSLHTASGLRLFSVLSLAWGFIADVDLE
SEKYRRLGEMRFTLGTFLRLAALRTYRGRLAYLPVGRVGSKTPASPVVVQQGPVDAHLVP
LEEPVPSHWTVVPDEDFVLVLALLHSHLGSEMFAAPMGRCAAGVMHLFYVRAGVSRAMLL
RLFLAMEKGRHMEYECPYLVYVPVVAFRLEPKDGKGVFAVDGELMVSEAVQGQVHPNYFW
MVSGCVEPPPSWKPQQMPPPEEPL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50237425
n/a
NameBDBM50237425
Synonyms:CHEMBL4101628
TypeSmall organic molecule
Emp. Form.C22H20N2O3S
Mol. Mass.392.471
SMILESCc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc3[nH]cnc3c2)c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: