BDBM50521403 CHEMBL4454046

SMILES O=C(Nc1ccc(cc1)C1=NCCN1)\C=C/c1ccc(\C=C/C(=O)Nc2ccc(cc2)C2=NCCN2)cc1

InChI Key InChIKey=KDQKMUCWBRINRA-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50521403   

TargetSphingomyelin phosphodiesterase 3(Rat)
Johns Hopkins University

Curated by ChEMBL
LigandPNGBDBM50521403(CHEMBL4454046)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of rat brain neutral sphingomyelinase pre-incubated for 30 mins before p-nitrophenyl/phosphorylcholine substrate addition by spectrophotom...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed