null

SMILES: C[C@H](CCc1ccc(O)cc1)NC(=O)Cc1c(-c2ccccc2)n(Cc2ccc(OCCN3CCCCC3)cc2)c2ccccc12

InChI Key: InChIKey=TYMRGXPQAWWLJN-SSEXGKCCSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50204795   

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))	BDBM50204795 ((R)-2-(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-2-ph...) Show SMILES C[C@H](CCc1ccc(O)cc1)NC(=O)Cc1c(-c2ccccc2)n(Cc2ccc(OCCN3CCCCC3)cc2)c2ccccc12 Show InChI InChI=1S/C40H45N3O3/c1-30(14-15-31-16-20-34(44)21-17-31)41-39(45)28-37-36-12-6-7-13-38(36)43(40(37)33-10-4-2-5-11-33)29-32-18-22-35(23-19-32)46-27-26-42-24-8-3-9-25-42/h2,4-7,10-13,16-23,30,44H,3,8-9,14-15,24-29H2,1H3,(H,41,45)/t30-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from full length human recombinant ERalpha after 3 hrs by scintillation proximity assay				Bioorg Med Chem Lett 17: 2322-8 (2007) Article DOI: 10.1016/j.bmcl.2007.01.054 BindingDB Entry DOI: 10.7270/Q2PC322G
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50204795 ((R)-2-(1-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-2-ph...) Show SMILES C[C@H](CCc1ccc(O)cc1)NC(=O)Cc1c(-c2ccccc2)n(Cc2ccc(OCCN3CCCCC3)cc2)c2ccccc12 Show InChI InChI=1S/C40H45N3O3/c1-30(14-15-31-16-20-34(44)21-17-31)41-39(45)28-37-36-12-6-7-13-38(36)43(40(37)33-10-4-2-5-11-33)29-32-18-22-35(23-19-32)46-27-26-42-24-8-3-9-25-42/h2,4-7,10-13,16-23,30,44H,3,8-9,14-15,24-29H2,1H3,(H,41,45)/t30-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	606	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]estradiol from full length human recombinant ERbeta after 3 hrs by scintillation proximity assay				Bioorg Med Chem Lett 17: 2322-8 (2007) Article DOI: 10.1016/j.bmcl.2007.01.054 BindingDB Entry DOI: 10.7270/Q2PC322G
					More data for this Ligand-Target Pair