BDBM50540337 CHEMBL4638718::US11427590, Entry 1::US20240115574, Entry 1

SMILES COc1ccc(cc1OC)-c1c(C)nc2c(cc(C)nn12)N1CC[C@H](C1)NC(C)=O

InChI Key InChIKey=FLIMRTXUPYBMEM-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50540337   

TargetSphingomyelin phosphodiesterase 3(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50540337(CHEMBL4638718 | US11427590, Entry 1 | US2024011557...)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of human recombinant full-length nSMase expressed in HEK293 cells using sphingomyelin as substrate measured after 1 hr by alkaline phospha...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetSphingomyelin phosphodiesterase 3(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50540337(CHEMBL4638718 | US11427590, Entry 1 | US2024011557...)
Affinity DataIC50: 1.00E+3nMAssay Description:The fluorescence based assay to monitor the activity of human nSMase2 in the presence or absence of potential inhibitors has been described recently....More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/7/2022
Entry Details
US Patent

TargetSphingomyelin phosphodiesterase 3(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50540337(CHEMBL4638718 | US11427590, Entry 1 | US2024011557...)
Affinity DataIC50: 1.00E+3nMAssay Description:TBDMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2024
Entry Details
US Patent

TargetPhosphatidylinositol 4-kinase beta(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50540337(CHEMBL4638718 | US11427590, Entry 1 | US2024011557...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of PI4K3beta (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed