Reaction Details Report a problem with these data
Target
Sphingosine kinase 1
Ligand
BDBM174122
Substrate
n/a
Meas. Tech.
Scintillation Proximity Assay
Ki
>10000±n/a nM
Citation
 Santos, WL; Lynch, KR; Macdonald, TL; Kennedy, A; Kharel, Y; Raje, MR; Houck, J Long chain base sphingosine kinase inhibitors US Patent  US9688668 Publication Date 6/27/2017 
Target
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:
MDPAGGPRGVLPRPCRVLVLLNPRGGKGKALQLFRSHVQPLLAEAEISFTLMLTERRNHARELVRSEELGRWDALVVMSGDGLMHEVVNGLMERPDWETAIQKPLCSLPAGSGNALAASLNHYAGYEQVTNEDLLTNCTLLLCRRLLSPMNLLSLHTASGLRLFSVLSLAWGFIADVDLESEKYRRLGEMRFTLGTFLRLAALRTYRGRLAYLPVGRVGSKTPASPVVVQQGPVDAHLVPLEEPVPSHWTVVPDEDFVLVLALLHSHLGSEMFAAPMGRCAAGVMHLFYVRAGVSRAMLLRLFLAMEKGRHMEYECPYLVYVPVVAFRLEPKDGKGVFAVDGELMVSEAVQGQVHPNYFWMVSGCVEPPPSWKPQQMPPPEEPL
  
Inhibitor
Name:
BDBM174122
Synonyms:
US9688668, 75
Type:
Small organic molecule
Emp. Form.:
C21H31N5O
Mol. Mass.:
369.5037
SMILES:
CCCCCCCc1cccc(c1)-c1noc(C[C@@H]2CCCN2C(N)=N)n1 |r|
Structure:
Search PDB for entries with ligand similarity: