Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM129631'   

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 (Homo sapiens (Human))	BDBM129631 (US8815934, No. 108) Show SMILES CC1CCCCN1CCOc1ccc(Cn2c(c(C)c3cc(O)ccc23)-c2ccc(O)cc2)cc1 Show InChI InChI=1S/C30H34N2O3/c1-21-5-3-4-16-31(21)17-18-35-27-13-6-23(7-14-27)20-32-29-15-12-26(34)19-28(29)22(2)30(32)24-8-10-25(33)11-9-24/h6-15,19,21,33-34H,3-5,16-18,20H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	4
Wyeth LLC US Patent					Assay Description The competition assay was performed in a 96-well plate (polystyrene*) which binds <2.0% of the total input [3H]-17beta-estradiol and each data point ...				US Patent US8815934 (2014) BindingDB Entry DOI: 10.7270/Q2PZ57H0
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