BDBM50275966 1-(2-{4-[8-Fluoro-4-(4-fluorophenyl)-2,3-dihydro-benzo[b]-oxepin-5-yl]-phenoxy}-ethyl)-pyrrolidine::CHEMBL511492

SMILES: Fc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1

InChI Key: InChIKey=DVBULXMSJAHUEU-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50275966   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Estradiol receptor beta (ERβ) (Homo sapiens (Human))	BDBM50275966 (1-(2-{4-[8-Fluoro-4-(4-fluorophenyl)-2,3-dihydro-b...) Show SMILES Fc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H27F2NO2/c29-22-7-3-20(4-8-22)25-13-17-33-27-19-23(30)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-31-14-1-2-15-31/h3-12,19H,1-2,13-18H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	262	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERbeta expressed in baculovirus infected insect cells by fluorescence polarizati...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50275966 (1-(2-{4-[8-Fluoro-4-(4-fluorophenyl)-2,3-dihydro-b...) Show SMILES Fc1ccc(cc1)C1=C(c2ccc(OCCN3CCCC3)cc2)c2ccc(F)cc2OCC1 |c:8| Show InChI InChI=1S/C28H27F2NO2/c29-22-7-3-20(4-8-22)25-13-17-33-27-19-23(30)9-12-26(27)28(25)21-5-10-24(11-6-21)32-18-16-31-14-1-2-15-31/h3-12,19H,1-2,13-18H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein labeled estradiol from human recombinant ERalpha expressed in baculovirus infected insect cells by fluorescence polarizat...				Bioorg Med Chem 16: 9554-73 (2008) Article DOI: 10.1016/j.bmc.2008.09.035 BindingDB Entry DOI: 10.7270/Q2MW2GZ8
					More data for this Ligand-Target Pair