BDBM54394 2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulfanyl]-phenyl}-acetamide::2-chloranyl-N-[4-[4-(2-chloranylethanoylamino)phenyl]sulfanylphenyl]ethanamide::2-chloro-N-[4-[4-[(2-chloroacetyl)amino]phenyl]sulfanylphenyl]acetamide::2-chloro-N-[4-[[4-[(2-chloro-1-oxoethyl)amino]phenyl]thio]phenyl]acetamide::2-chloro-N-[4-[[4-[(2-chloroacetyl)amino]phenyl]thio]phenyl]acetamide::MLS000770022::SMR000434754::cid_1934236

SMILES ClCC(=O)Nc1ccc(Sc2ccc(NC(=O)CCl)cc2)cc1

InChI Key InChIKey=BNJPNTRUYDXTGI-UHFFFAOYSA-N

Data  5 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 7 hits for monomerid = 54394   

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

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataIC50:  2.71E+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
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataEC50:  1.01E+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 DepthDetails PCBioAssay
TargetHeat shock factor protein 1(Mus musculus)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataEC50:  3.68E+3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetX-box-binding protein 1(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataIC50:  4.90E+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 DepthDetails PCBioAssay
TargetDNA damage-inducible transcript 3 protein(Mus musculus)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataIC50:  4.80E+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 DepthDetails PCBioAssay
TargetDNA damage-inducible transcript 3 protein(Mus musculus)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataIC50:  4.80E+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 DepthDetails PCBioAssay
TargetTumor necrosis factor(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54394(2-Chloro-N-{4-[4-(2-chloro-acetylamino)-phenylsulf...)
Affinity DataIC50:  1.62E+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