BDBM50031815 CHEMBL3360849

SMILES: COc1cc(cc(OC)c1OC)[C@H]1[C@@H](C(=O)N1c1ccc(O)cc1)c1ccc(O)cc1

InChI Key: InChIKey=QKLDKBVOBCLOPO-VXKWHMMOSA-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 = 50031815   

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))	BDBM50031815 (CHEMBL3360849) Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H](C(=O)N1c1ccc(O)cc1)c1ccc(O)cc1 |r| Show InChI InChI=1S/C24H23NO6/c1-29-19-12-15(13-20(30-2)23(19)31-3)22-21(14-4-8-17(26)9-5-14)24(28)25(22)16-6-10-18(27)11-7-16/h4-13,21-22,26-27H,1-3H3/t21-,22-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.44E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein-labeled estrogen from human recombinant ERbeta by fluorescence polarization based competitive binding affinity assay				J Med Chem 57: 9370-82 (2014) Article DOI: 10.1021/jm500670d BindingDB Entry DOI: 10.7270/Q2BR8TSK
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50031815 (CHEMBL3360849) Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H](C(=O)N1c1ccc(O)cc1)c1ccc(O)cc1 |r| Show InChI InChI=1S/C24H23NO6/c1-29-19-12-15(13-20(30-2)23(19)31-3)22-21(14-4-8-17(26)9-5-14)24(28)25(22)16-6-10-18(27)11-7-16/h4-13,21-22,26-27H,1-3H3/t21-,22-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trinity College Curated by ChEMBL					Assay Description Displacement of fluorescein-labeled estrogen from human recombinant ERalpha by fluorescence polarization based competitive binding affinity assay				J Med Chem 57: 9370-82 (2014) Article DOI: 10.1021/jm500670d BindingDB Entry DOI: 10.7270/Q2BR8TSK
					More data for this Ligand-Target Pair