Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Estrogen receptor beta' and Ligand = 'BDBM50471080'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Estrogen receptor beta (Homo sapiens (Human))	BDBM50471080 (CHEMBL1627431) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C19H26O3/c1-19-7-6-13-14(16(19)4-5-18(19)22)3-2-11-9-17(21)12(10-20)8-15(11)13/h8-9,13-14,16,18,20-22H,2-7,10H2,1H3/t13-,14+,16-,18-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	342	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Affinity estrogen receptor of MCF-7 human mammary cancer cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50471080 (CHEMBL1627431) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C19H26O3/c1-19-7-6-13-14(16(19)4-5-18(19)22)3-2-11-9-17(21)12(10-20)8-15(11)13/h8-9,13-14,16,18,20-22H,2-7,10H2,1H3/t13-,14+,16-,18-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	146	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Affinity for estrogen receptor				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50471080 (CHEMBL1627431) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C19H26O3/c1-19-7-6-13-14(16(19)4-5-18(19)22)3-2-11-9-17(21)12(10-20)8-15(11)13/h8-9,13-14,16,18,20-22H,2-7,10H2,1H3/t13-,14+,16-,18-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.80	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Induction of pS2 mRNA expression in human MCF-7 mammary carcinoma cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50471080 (CHEMBL1627431) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C19H26O3/c1-19-7-6-13-14(16(19)4-5-18(19)22)3-2-11-9-17(21)12(10-20)8-15(11)13/h8-9,13-14,16,18,20-22H,2-7,10H2,1H3/t13-,14+,16-,18-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Induction of pS2 mRNA expression in human MCF-7 mammary carcinoma cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair