BDBM54346 MLS001003419::N-(4-ethylbenzyl)-3-[3-keto-4-(4-methoxyphenyl)quinoxalin-2-yl]-N-methyl-propionamide::N-[(4-ethylphenyl)methyl]-3-[4-(4-methoxyphenyl)-3-oxidanylidene-quinoxalin-2-yl]-N-methyl-propanamide::N-[(4-ethylphenyl)methyl]-3-[4-(4-methoxyphenyl)-3-oxo-2-quinoxalinyl]-N-methylpropanamide::N-[(4-ethylphenyl)methyl]-3-[4-(4-methoxyphenyl)-3-oxoquinoxalin-2-yl]-N-methylpropanamide::SMR000344889::cid_2476519

SMILES CCc1ccc(CN(C)C(=O)CCc2nc3ccccc3n(-c3ccc(OC)cc3)c2=O)cc1

InChI Key InChIKey=LTOPUBIXIPBCDP-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  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 = 54346   

TargetNucleotide-binding oligomerization domain-containing protein 2(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54346(cid_2476519 | MLS001003419 | N-[(4-ethylphenyl)met...)
Affinity DataIC50: 5.96E+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
LigandPNGBDBM54346(cid_2476519 | MLS001003419 | N-[(4-ethylphenyl)met...)
Affinity DataEC50:  1.27E+4nMAssay 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
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54346(cid_2476519 | MLS001003419 | N-[(4-ethylphenyl)met...)
Affinity DataIC50: 2.00E+4nMAssay 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
TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM54346(cid_2476519 | MLS001003419 | N-[(4-ethylphenyl)met...)
Affinity DataEC50: >2.60E+5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay