BDBM39914 2-(4-chloro-2-methyl-phenoxy)acetic acid [2-(dimethylamino)-2-keto-1-methyl-ethyl] ester::2-(4-chloro-2-methylphenoxy)acetic acid [1-(dimethylamino)-1-oxopropan-2-yl] ester::MLS000071533::SMR000039312::[1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-(4-chloranyl-2-methyl-phenoxy)ethanoate::[1-(dimethylamino)-1-oxopropan-2-yl] 2-(4-chloro-2-methylphenoxy)acetate::cid_658406

SMILES CC(OC(=O)COc1ccc(Cl)cc1C)C(=O)N(C)C

InChI Key InChIKey=DJIRXGKRSAVJEZ-UHFFFAOYSA-N

Data  5 IC50

  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 5 hits for monomerid = 39914   

TargetEstrogen receptor beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM39914([1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-...)
Affinity DataIC50: 23nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
LigandPNGBDBM39914([1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-...)
Affinity DataIC50: 1.53E+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:
1/4/2012
Entry Details
PCBioAssay
TargetEstrogen receptor beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM39914([1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-...)
Affinity DataIC50: 1.67E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetEstrogen receptor(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM39914([1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-...)
Affinity DataIC50: 3.70E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2011
Entry Details
PCBioAssay
TargetNuclear receptor subfamily 4 group A member 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM39914([1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-...)
Affinity DataIC50: 1.00E+5nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2011
Entry Details
PCBioAssay