BDBM50230558 CHEMBL2112949

SMILES: Oc1ccc2c3C(c4ccccc4-c3ccc2c1)c1ccc(OCCN2CCCCC2)cc1

InChI Key: InChIKey=QQZQFFQHCZSFNV-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50230558   

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))	BDBM50230558 (CHEMBL2112949) Show SMILES Oc1ccc2c3C(c4ccccc4-c3ccc2c1)c1ccc(OCCN2CCCCC2)cc1 Show InChI InChI=1S/C30H29NO2/c32-23-11-15-25-22(20-23)10-14-28-26-6-2-3-7-27(26)29(30(25)28)21-8-12-24(13-9-21)33-19-18-31-16-4-1-5-17-31/h2-3,6-15,20,29,32H,1,4-5,16-19H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Eli Lilly and Company Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from Estrogen receptor in MCF-7 cells				J Med Chem 35: 931-8 (1992) BindingDB Entry DOI: 10.7270/Q2V98B9P
					More data for this Ligand-Target Pair