BDBM54513 3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-phenyl]-1,2-oxazole::3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylphenyl]-1,2-oxazole::3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazino]sulfonyl-phenyl]isoxazole::3-methyl-5-[4-methyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]sulfonyl]phenyl]isoxazole::MLS001095049::SMR000630356::cid_24793715

SMILES Cc1cc(on1)-c1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O

InChI Key InChIKey=JVYYNKOFPZEOOM-UHFFFAOYSA-N

Data  4 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 5 hits for monomerid = 54513   

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

Curated by PubChem BioAssay
LigandPNGBDBM54513(3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin...)
Affinity DataIC50:  7.60E+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 DepthDetails PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54513(3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin...)
Affinity DataEC50:  2.09E+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 DepthDetails PCBioAssay
TargetTumor necrosis factor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54513(3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin...)
Affinity DataIC50:  2.11E+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 DepthDetails PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54513(3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin...)
Affinity DataIC50:  2.42E+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 DepthDetails PCBioAssay
TargetTumor necrosis factor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54513(3-methyl-5-[4-methyl-3-[4-(4-nitrophenyl)piperazin...)
Affinity DataIC50:  2.36E+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 DepthDetails PCBioAssay