BDBM59541 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxoethylidene]hydrazinyl]-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid methyl ester::3-[N'-[2-(4-chlorophenyl)-1-cyano-2-keto-ethylidene]hydrazino]-4-isopropylsulfonyl-thiophene-2-carboxylic acid methyl ester::MLS000859220::SMR000459399::cid_2819758::methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanylidene-ethylidene]hydrazinyl]-4-propan-2-ylsulfonyl-thiophene-2-carboxylate::methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxoethylidene]hydrazinyl]-4-propan-2-ylsulfonylthiophene-2-carboxylate::methyl 3-{2-[2-(4-chlorophenyl)-1-cyano-2-oxoethylidene]hydrazino}-4-(isopropylsulfonyl)thiophene-2-carboxylate

SMILES COC(=O)c1scc(c1NN=C(C#N)C(=O)c1ccc(Cl)cc1)S(=O)(=O)C(C)C

InChI Key InChIKey=QKIRKKFLUQRPNN-UHFFFAOYSA-N

Data  4 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 59541   

TargetNucleotide-binding oligomerization domain-containing protein 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM59541(methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanyl...)
Affinity DataEC50:  2.17E+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
LigandPNGBDBM59541(methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanyl...)
Affinity DataIC50: 5.43E+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
LigandPNGBDBM59541(methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanyl...)
Affinity DataIC50: 5.88E+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:
7/9/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM59541(methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanyl...)
Affinity DataIC50: 1.09E+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:
7/9/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM59541(methyl 3-[2-[2-(4-chlorophenyl)-1-cyano-2-oxidanyl...)
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