BDBM50085039 CHEMBL3425530

SMILES: Cc1cc2c(Cc3ccc(\C=C\C(O)=O)cc3)c(-c3ccc(OC(F)(F)F)cc3)c(=O)oc2cc1O

InChI Key: InChIKey=KCFNISAIRYHDET-IZZDOVSWSA-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 = 50085039   

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
Estrogen receptor (Homo sapiens (Human))	BDBM50085039 (CHEMBL3425530) Show SMILES Cc1cc2c(Cc3ccc(\C=C\C(O)=O)cc3)c(-c3ccc(OC(F)(F)F)cc3)c(=O)oc2cc1O Show InChI InChI=1S/C27H19F3O6/c1-15-12-20-21(13-17-4-2-16(3-5-17)6-11-24(32)33)25(26(34)35-23(20)14-22(15)31)18-7-9-19(10-8-18)36-27(28,29)30/h2-12,14,31H,13H2,1H3,(H,32,33)/b11-6+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Suppression of ER alpha in human MCF7 cells after 24 hrs by immunostaining analysis				J Med Chem 58: 3522-33 (2015) Article DOI: 10.1021/acs.jmedchem.5b00066 BindingDB Entry DOI: 10.7270/Q2M32XGF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50085039 (CHEMBL3425530) Show SMILES Cc1cc2c(Cc3ccc(\C=C\C(O)=O)cc3)c(-c3ccc(OC(F)(F)F)cc3)c(=O)oc2cc1O Show InChI InChI=1S/C27H19F3O6/c1-15-12-20-21(13-17-4-2-16(3-5-17)6-11-24(32)33)25(26(34)35-23(20)14-22(15)31)18-7-9-19(10-8-18)36-27(28,29)30/h2-12,14,31H,13H2,1H3,(H,32,33)/b11-6+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to ER alpha (unknown origin) by LanthaScreen TR-FRET competitive binding assay				J Med Chem 58: 3522-33 (2015) Article DOI: 10.1021/acs.jmedchem.5b00066 BindingDB Entry DOI: 10.7270/Q2M32XGF
					More data for this Ligand-Target Pair