Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM129655'   

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))	BDBM129655 (US8815934, No. 139) Show SMILES Oc1ccc(cc1)-c1c(C#N)c2cc(O)ccc2n1Cc1ccc(OCCN2CCCCCC2)cc1 Show InChI InChI=1S/C30H31N3O3/c31-20-28-27-19-25(35)11-14-29(27)33(30(28)23-7-9-24(34)10-8-23)21-22-5-12-26(13-6-22)36-18-17-32-15-3-1-2-4-16-32/h5-14,19,34-35H,1-4,15-18,21H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	23	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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