Reaction Details Report a problem with these data
Target
Sphingosine-1-phosphate lyase 1
Ligand
BDBM50158336
Substrate
n/a
Meas. Tech.
ChEMBL_2063500 (CHEMBL4718753)
IC50
52400±n/a nM
Citation
 Sanllehí, P; Abad, JL; Bujons, J; Casas, J; Delgado, A Studies on the inhibition of sphingosine-1-phosphate lyase by stabilized reaction intermediates and stereodefined azido phosphates. Eur J Med Chem 123:905-915 (2016) [PubMed]  Article 
Target
Name:
Sphingosine-1-phosphate lyase 1
Synonyms:
SGPL1_MOUSE | Sgpl1 | Spl
Type:
PROTEIN
Mol. Mass.:
63699.17
Organism:
Mus musculus
Description:
ChEMBL_519984
Residue:
568
Sequence:
MPGTDLLKLKDFEPYLEILESYSTKAKNYVNGYCTKYEPWQLIAWSVLCTLLIVWVYELIFQPESLWSRFKKKLFKLIRKMPFIGRKIEQQVSKAKKDLVKNMPFLKVDKDYVKTLPAQGMGTAEVLERLKEYSSMDGSWQEGKASGAVYNGEPKLTELLVQAYGEFTWSNPLHPDIFPGLRKLEAEIVRMTCSLFNGGPDSCGCVTSGGTESILMACKAYRDLALEKGIKTPEIVAPESAHAAFDKAAHYFGMKIVRVALKKNMEVDVQAMKRAISRNTAMLVCSTPQFPHGVMDPVPEVAKLAVRYKIPLHVDACLGGFLIVFMEKAGYPLEKPFDFRVKGVTSISADTHKYGYAPKGSSVVMYSNEKYRTYQFFVGADWQGGVYASPSIAGSRPGGIIAACWAALMHFGENGYVEATKQIIKTARFLKSELENIKNIFIFGDPQLSVIALGSNDFDIYRLSNMMSAKGWNFNYLQFPRSIHFCITLVHTRKRVAIQFLKDIRESVTQIMKNPKAKTTGMGAIYGMAQATIDRKLVAEISSVFLDCLYTTDPVTQGNQMNGSPKPR
  
Inhibitor
Name:
BDBM50158336
Synonyms:
2-(4-octylphenethyl)-2-aminopropane-1,3-diol | 2-Amino-2-[2-(4-octyl-phenyl)-ethyl]-propane-1,3-diol | 2-amino-2-(4-octylphenethyl)propane-1,3-diol | 2-amino-2-(4-octylphenyl)ethylpropane-1,3-diol | CHEMBL314854 | FINGOLIMOD | FINGOLIMOD HYDROCHLORIDE
Type:
Small organic molecule
Emp. Form.:
C19H33NO2
Mol. Mass.:
307.4708
SMILES:
CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1
Structure:
Search PDB for entries with ligand similarity: