BDBM54187 1,3,7-trimethyl-8-(2-naphthalenyloxy)purine-2,6-dione::1,3,7-trimethyl-8-(2-naphthoxy)xanthine::1,3,7-trimethyl-8-(2-naphthyloxy)-3,7-dihydro-1H-purine-2,6-dione::1,3,7-trimethyl-8-naphthalen-2-yloxy-purine-2,6-dione::1,3,7-trimethyl-8-naphthalen-2-yloxypurine-2,6-dione::MLS000538928::SMR000144765::cid_845567

SMILES Cn1c(Oc2ccc3ccccc3c2)nc2n(C)c(=O)n(C)c(=O)c12

InChI Key InChIKey=JWBMNROGQMNFPZ-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 54187   

TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54187(SMR000144765 | MLS000538928 | 1,3,7-trimethyl-8-(2...)
Affinity DataIC50: 3.32E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 2(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54187(SMR000144765 | MLS000538928 | 1,3,7-trimethyl-8-(2...)
Affinity DataIC50: 3.88E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2011
Entry Details
PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54187(SMR000144765 | MLS000538928 | 1,3,7-trimethyl-8-(2...)
Affinity DataEC50:  6.60E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay