BDBM50128902 CHEMBL59342::Pyridin-4-ylmethyl-carbamic acid (E)-(2S,3R)-3-hydroxy-2-isobutyrylamino-octadec-4-enyl ester

SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COC(=O)NCc1ccncc1)NC(=O)C(C)C

InChI Key InChIKey=XTWYADQOIICZPU-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50128902   

TargetSphingomyelin phosphodiesterase 2(Rat)
Taisho Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50128902(Pyridin-4-ylmethyl-carbamic acid (E)-(2S,3R)-3-hyd...)
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibitory concentration against the membrane neutral magnesium-dependent Sphingomyelinase (N-SMase) using rat brain microsomes as the enzyme sourceMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2012
Entry Details Article
PubMed
TargetSphingomyelin phosphodiesterase 2(Rat)
Taisho Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50128902(Pyridin-4-ylmethyl-carbamic acid (E)-(2S,3R)-3-hyd...)
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibition of rat brain microsomes nSMaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed