BDBM40014 MLS000043380::N-(2-furanylmethyl)-2-(5-methyl-2-furanyl)-4-quinolinecarboxamide::N-(2-furfuryl)-2-(5-methyl-2-furyl)cinchoninamide::N-(2-furylmethyl)-2-(5-methyl-2-furyl)quinoline-4-carboxamide::N-(furan-2-ylmethyl)-2-(5-methylfuran-2-yl)quinoline-4-carboxamide::SMR000020197::cid_3237608

SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2ccco2)c2ccccc2n1

InChI Key InChIKey=XDJGRFVVVPCXCN-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 40014   

TargetEstrogen receptor(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40014(N-(2-furylmethyl)-2-(5-methyl-2-furyl)quinoline-4-...)
Affinity DataIC50: 6.84E+3nMAssay 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
TargetEstrogen receptor beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40014(N-(2-furylmethyl)-2-(5-methyl-2-furyl)quinoline-4-...)
Affinity DataIC50: 5.00E+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 beta(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40014(N-(2-furylmethyl)-2-(5-methyl-2-furyl)quinoline-4-...)
Affinity DataIC50: 3.37E+3nMAssay 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
LigandPNGBDBM40014(N-(2-furylmethyl)-2-(5-methyl-2-furyl)quinoline-4-...)
Affinity DataIC50: 4.39E+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:
1/4/2012
Entry Details
PCBioAssay