Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-1 [1091-1325]' and Ligand = 'BDBM231074'   

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
Poly [ADP-ribose] polymerase tankyrase-1 [1091-1325] (Homo sapiens (Human))	BDBM231074 (US9340549, 98) Show SMILES CC1(C)OC(=O)N([C@H]1c1ccccc1)[C@H]1CC[C@@H](CC1)c1cnc2[nH]c(=O)n(-c3ncccn3)c2c1 |r,wU:7.8,17.22,wD:14.15,(-7.97,.64,;-6.64,1.41,;-7.41,.08,;-6.64,2.95,;-5.17,3.43,;-4.4,4.76,;-4.27,2.18,;-5.17,.93,;-4.78,-.55,;-5.86,-1.64,;-5.47,-3.13,;-3.98,-3.53,;-2.89,-2.44,;-3.29,-.95,;-2.73,2.18,;-1.96,.85,;-.42,.85,;.35,2.18,;-.42,3.51,;-1.96,3.51,;1.89,2.18,;2.66,3.51,;4.2,3.51,;4.97,2.18,;6.48,1.86,;6.64,.33,;7.97,-.44,;5.23,-.3,;4.83,-1.79,;3.35,-2.18,;2.95,-3.67,;4.04,-4.76,;5.52,-4.36,;5.92,-2.87,;4.2,.85,;2.66,.85,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.316	n/a	n/a	n/a	n/a	n/a	25
AMGEN INC. US Patent					Assay Description The tankyrase 1 biochemical activity of the compounds was assayed in the following assay buffer (50 mM MOPS pH7.5, 100 mM NaCl, 2.5 mM MgCl2, 0.01% T...				US Patent US9340549 (2016) BindingDB Entry DOI: 10.7270/Q2SN07VD
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