BDBM50048936 1-[4-Carboxypropyl]-3,7-Dimethylxanthine (Metabolite-V)::4-(3,7-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-purin-1-yl)-butyric acid::CHEMBL1343

SMILES Cn1cnc2n(C)c(=O)n(CCCC(O)=O)c(=O)c12

InChI Key InChIKey=WKASGTGXOGALBG-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 = 50048936   

TargetTumor necrosis factor(Homo sapiens (Human))
University Of California

Curated by ChEMBL
LigandPNGBDBM50048936(1-[4-Carboxypropyl]-3,7-Dimethylxanthine (Metaboli...)
Affinity DataIC50: >2.00E+5nMAssay Description:TNF-alpha production in PBMC by ELISA methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed