BDBM50126726 CHEMBL282319::Isoquinoline-5-sulfonic acid 4-{(S)-2-[(isoquinoline-5-sulfonyl)-methyl-amino]-3-oxo-3-[4-(3-trifluoromethyl-phenyl)-piperazin-1-yl]-propyl}-phenyl ester

SMILES CN([C@@H](Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)S(=O)(=O)c1cccc2cnccc12

InChI Key InChIKey=JFQFABBCJXBVLO-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 = 50126726   

TargetP2X purinoceptor 7(Human)
Università

Curated by ChEMBL
LigandPNGBDBM50126726(Isoquinoline-5-sulfonic acid 4-{(S)-2-[(isoquinoli...)
Affinity DataIC50: 31nMAssay Description:Antagonistic activity against P2X7 receptor measured as the ATP dependent calcium influx in human monocytesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed