null

SMILES: CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(NC2CCc3cc(O)ccc3C2)n1

InChI Key: InChIKey=KBOJOJGGAJJXER-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50121586   

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 beta (Homo sapiens (Human))	BDBM50121586 (6-[4-(4-Methyl-piperazin-1-yl)-6-(3-phenyl-propyla...) Show SMILES CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(NC2CCc3cc(O)ccc3C2)n1 Show InChI InChI=1S/C27H35N7O/c1-33-14-16-34(17-15-33)27-31-25(28-13-5-8-20-6-3-2-4-7-20)30-26(32-27)29-23-11-9-22-19-24(35)12-10-21(22)18-23/h2-4,6-7,10,12,19,23,35H,5,8-9,11,13-18H2,1H3,(H2,28,29,30,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research and Development Curated by ChEMBL					Assay Description In vitro binding affinity towards human Estrogen receptor 2 using [3H]-17-beta-estradiol as radioligand				J Med Chem 45: 5492-505 (2002) BindingDB Entry DOI: 10.7270/Q2J965RW
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50121586 (6-[4-(4-Methyl-piperazin-1-yl)-6-(3-phenyl-propyla...) Show SMILES CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(NC2CCc3cc(O)ccc3C2)n1 Show InChI InChI=1S/C27H35N7O/c1-33-14-16-34(17-15-33)27-31-25(28-13-5-8-20-6-3-2-4-7-20)30-26(32-27)29-23-11-9-22-19-24(35)12-10-21(22)18-23/h2-4,6-7,10,12,19,23,35H,5,8-9,11,13-18H2,1H3,(H2,28,29,30,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research and Development Curated by ChEMBL					Assay Description In vitro binding affinity towards human Estrogen receptor alpha using [3H]-17-beta-estradiol as radioligand				J Med Chem 45: 5492-505 (2002) BindingDB Entry DOI: 10.7270/Q2J965RW
					More data for this Ligand-Target Pair