null

SMILES: CC[C@@H](CN1CCCC1)Oc1ccc(cc1)[C@@H]1Oc2ccc(O)cc2S[C@@H]1c1ccc(O)cc1

InChI Key: InChIKey=NWKCPPJDKLUHDY-MXSCXNJPSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50157164   

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))	BDBM50157164 (CHEMBL183092 | i(2S,3R)-3-(4-Hydroxy-phenyl)-2-[4-...) Show SMILES CC[C@@H](CN1CCCC1)Oc1ccc(cc1)[C@@H]1Oc2ccc(O)cc2S[C@@H]1c1ccc(O)cc1 Show InChI InChI=1S/C28H31NO4S/c1-2-23(18-29-15-3-4-16-29)32-24-12-7-19(8-13-24)27-28(20-5-9-21(30)10-6-20)34-26-17-22(31)11-14-25(26)33-27/h5-14,17,23,27-28,30-31H,2-4,15-16,18H2,1H3/t23-,27-,28+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of bindign to recombinant human estrogen receptor alpha				Bioorg Med Chem Lett 15: 107-13 (2004) Article DOI: 10.1016/j.bmcl.2004.10.036 BindingDB Entry DOI: 10.7270/Q2GM86S0
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50157164 (CHEMBL183092 | i(2S,3R)-3-(4-Hydroxy-phenyl)-2-[4-...) Show SMILES CC[C@@H](CN1CCCC1)Oc1ccc(cc1)[C@@H]1Oc2ccc(O)cc2S[C@@H]1c1ccc(O)cc1 Show InChI InChI=1S/C28H31NO4S/c1-2-23(18-29-15-3-4-16-29)32-24-12-7-19(8-13-24)27-28(20-5-9-21(30)10-6-20)34-26-17-22(31)11-14-25(26)33-27/h5-14,17,23,27-28,30-31H,2-4,15-16,18H2,1H3/t23-,27-,28+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding to recombinant human estrogen receptor beta				Bioorg Med Chem Lett 15: 107-13 (2004) Article DOI: 10.1016/j.bmcl.2004.10.036 BindingDB Entry DOI: 10.7270/Q2GM86S0
					More data for this Ligand-Target Pair