Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase 1' and Ligand = 'BDBM50297845'   

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 1 (Homo sapiens (Human))	BDBM50297845 (7-(pyrrolidin-1-ylmethyl)-1,2,3,3a-tetrahydropyrro...) Show SMILES O=C1Nc2cc(CN3CCCC3)ccc2N2CCCC12 Show InChI InChI=1S/C16H21N3O/c20-16-15-4-3-9-19(15)14-6-5-12(10-13(14)17-16)11-18-7-1-2-8-18/h5-6,10,15H,1-4,7-9,11H2,(H,17,20)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	96	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of PARP1 by microplate scintillation counting				Bioorg Med Chem Lett 19: 4050-4 (2009) Article DOI: 10.1016/j.bmcl.2009.06.016 BindingDB Entry DOI: 10.7270/Q2QJ7HB0
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50297845 (7-(pyrrolidin-1-ylmethyl)-1,2,3,3a-tetrahydropyrro...) Show SMILES O=C1Nc2cc(CN3CCCC3)ccc2N2CCCC12 Show InChI InChI=1S/C16H21N3O/c20-16-15-4-3-9-19(15)14-6-5-12(10-13(14)17-16)11-18-7-1-2-8-18/h5-6,10,15H,1-4,7-9,11H2,(H,17,20)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of PARP1 in human C41 cells by DAPI staining-based FITC analysis				Bioorg Med Chem Lett 19: 4050-4 (2009) Article DOI: 10.1016/j.bmcl.2009.06.016 BindingDB Entry DOI: 10.7270/Q2QJ7HB0
					More data for this Ligand-Target Pair