BDBM50160297 (3S,4R)-3-Phenyl-4-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-isothiochroman-7-ol::CHEMBL183333

SMILES Oc1ccc2[C@H]([C@H](SCc2c1)c1ccccc1)c1ccc(OCCN2CCCC2)cc1

InChI Key InChIKey=KNKMMFVVMHOSMW-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50160297   

TargetEstrogen receptor(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50160297((3S,4R)-3-Phenyl-4-[4-(2-pyrrolidin-1-yl-ethoxy)-p...)
Affinity DataIC50: 0.600nMAssay Description:Binding affinity for human estrogen receptor alphaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEstrogen receptor beta(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50160297((3S,4R)-3-Phenyl-4-[4-(2-pyrrolidin-1-yl-ethoxy)-p...)
Affinity DataIC50: 2.10nMAssay Description:Binding affinity for human estrogen receptor betaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed