Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-1 [1112-1317]' and Ligand = 'BDBM199998'   

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 [1112-1317] (Homo sapiens (Human))	BDBM199998 (US9227982, 16) Show SMILES CC(C)N(Cc1nc2CCOCc2c(=O)[nH]1)C(=O)CCc1ccccc1 Show InChI InChI=1S/C20H25N3O3/c1-14(2)23(19(24)9-8-15-6-4-3-5-7-15)12-18-21-17-10-11-26-13-16(17)20(25)22-18/h3-7,14H,8-13H2,1-2H3,(H,21,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.90E+4	n/a	n/a	n/a	n/a	n/a	25
NOVARTIS AG US Patent					Assay Description The human tankyrase 1 PARP catalytic domain, TNKS1P, was cloned into a pDONR221 vector using the Invitrogen Gateway Technology. This entry clone was ...				US Patent US9227982 (2016) BindingDB Entry DOI: 10.7270/Q21R6PBJ
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