BDBM50217398 CHEMBL151400

SMILES: COc1ccc(cc1)-c1sc2cc(OC)ccc2c1C(=O)c1ccc(CCCN2CCCCC2)cc1

InChI Key: InChIKey=YWMGBZLHXVIJDF-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 = 50217398   

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))	BDBM50217398 (CHEMBL151400) Show SMILES COc1ccc(cc1)-c1sc2cc(OC)ccc2c1C(=O)c1ccc(CCCN2CCCCC2)cc1 Show InChI InChI=1S/C31H33NO3S/c1-34-25-14-12-24(13-15-25)31-29(27-17-16-26(35-2)21-28(27)36-31)30(33)23-10-8-22(9-11-23)7-6-20-32-18-4-3-5-19-32/h8-17,21H,3-7,18-20H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibition of estrogen-stimulated MCF-7 cell proliferation				Bioorg Med Chem Lett 9: 523-8 (1999) BindingDB Entry DOI: 10.7270/Q22Z17R1
					More data for this Ligand-Target Pair