Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-1' and Ligand = 'BDBM50234917'   

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 (Homo sapiens (Human))	BDBM50234917 (CHEMBL4080163) Show SMILES Cc1cccc2c1nc(CCC(O)=O)[nH]c2=O Show InChI InChI=1S/C12H12N2O3/c1-7-3-2-4-8-11(7)13-9(14-12(8)17)5-6-10(15)16/h2-4H,5-6H2,1H3,(H,15,16)(H,13,14,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged TNKS1 (1001 to 1327 residues) expressed in baculovirus infected sf9 cells using TACS-Sapphire a...				J Med Chem 60: 814-820 (2017) Article DOI: 10.1021/acs.jmedchem.6b01574 BindingDB Entry DOI: 10.7270/Q20R9RPP
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