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TargetSphingomyelin phosphodiesterase
LigandBDBM50370079
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1737276 (CHEMBL4153026)
IC50 290±n/a nM
Citation Yang, KNong, KGu, QDong, JWang, J Discovery of N-hydroxy-3-alkoxybenzamides as direct acid sphingomyelinase inhibitors using a ligand-based pharmacophore model. Eur J Med Chem151:389-400 (2018) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Sphingomyelin phosphodiesterase
Name:Sphingomyelin phosphodiesterase
Synonyms:3.1.4.12 | ASM | ASM_HUMAN | Acid sphingomyelinase | SMPD1 | Sphingomyelin phosphodiesterase | aSMase
Type:PROTEIN
Mol. Mass.:69945.03
Organism:Homo sapiens
Description:ChEMBL_11570
Residue:631
Sequence:
MPRYGASLRQSCPRSGREQGQDGTAGAPGLLWMGLVLALALALALALALSDSRVLWAPAE
AHPLSPQGHPARLHRIVPRLRDVFGWGNLTCPICKGLFTAINLGLKKEPNVARVGSVAIK
LCNLLKIAPPAVCQSIVHLFEDDMVEVWRRSVLSPSEACGLLLGSTCGHWDIFSSWNISL
PTVPKPPPKPPSPPAPGAPVSRILFLTDLHWDHDYLEGTDPDCADPLCCRRGSGLPPASR
PGAGYWGEYSKCDLPLRTLESLLSGLGPAGPFDMVYWTGDIPAHDVWHQTRQDQLRALTT
VTALVRKFLGPVPVYPAVGNHESTPVNSFPPPFIEGNHSSRWLYEAMAKAWEPWLPAEAL
RTLRIGGFYALSPYPGLRLISLNMNFCSRENFWLLINSTDPAGQLQWLVGELQAAEDRGD
KVHIIGHIPPGHCLKSWSWNYYRIVARYENTLAAQFFGHTHVDEFEVFYDEETLSRPLAV
AFLAPSATTYIGLNPGYRVYQIDGNYSGSSHVVLDHETYILNLTQANIPGAIPHWQLLYR
ARETYGLPNTLPTAWHNLVYRMRGDMQLFQTFWFLYHKGHPPSEPCGTPCRLATLCAQLS
ARADSPALCRHLMPDGSLPEAQSLWPRPLFC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50370079
n/a
NameBDBM50370079
Synonyms:CHEMBL4167088
TypeSmall organic molecule
Emp. Form.C12H29NO8P2
Mol. Mass.377.3081
SMILESCCCCCCCCCCCC(N)(OP(O)(O)=O)OP(O)(O)=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: