BDBM54373 1-Heptyl-4-hydroxy-2-oxo-1,2-dihydro-quinoline-3-carboxylic acid pyrazin-2-ylamide::1-heptyl-2-hydroxy-4-keto-N-pyrazin-2-yl-quinoline-3-carboxamide::1-heptyl-2-hydroxy-4-oxo-N-(2-pyrazinyl)-3-quinolinecarboxamide::1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3-carboxamide::1-heptyl-2-oxidanyl-4-oxidanylidene-N-pyrazin-2-yl-quinoline-3-carboxamide::MLS001047353::SMR000427414::cid_1593351

SMILES CCCCCCCn1c2ccccc2c(O)c(C(=O)Nc2cnccn2)c1=O

InChI Key InChIKey=IONTWAIDPPMSMW-UHFFFAOYSA-N

Data  8 IC50  1 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 9 hits for monomerid = 54373   

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

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 6.85E+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
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataEC50:  6.35E+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
TargetNucleotide-binding oligomerization domain-containing protein 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 5.60E+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:
7/9/2011
Entry Details
PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 2(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 8.05E+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:
7/9/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 3.18E+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:
7/9/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
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
TargetDNA damage-inducible transcript 3 protein(Mouse)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 2.87E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/12/2011
Entry Details
PCBioAssay
TargetDNA damage-inducible transcript 3 protein(Mouse)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 2.87E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetX-box-binding protein 1(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54373(1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3...)
Affinity DataIC50: 1.79E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay