Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase 1' and Ligand = 'BDBM50120274'   

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))	BDBM50120274 (3-(2,4-Dioxo-3,4,5,6,7,8-hexahydro-2H-quinazolin-1...) Show SMILES O=C(CCn1c2CCCCc2c(=O)[nH]c1=O)NCC(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C23H23N3O4/c27-20(17-10-9-15-5-1-2-6-16(15)13-17)14-24-21(28)11-12-26-19-8-4-3-7-18(19)22(29)25-23(26)30/h1-2,5-6,9-10,13H,3-4,7-8,11-12,14H2,(H,24,28)(H,25,29,30)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Bayer AG Curated by ChEMBL					Assay Description Inhibitory activity against human recombinant PARP-1				Bioorg Med Chem Lett 12: 3187-90 (2002) BindingDB Entry DOI: 10.7270/Q2VX0FTT
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50120274 (3-(2,4-Dioxo-3,4,5,6,7,8-hexahydro-2H-quinazolin-1...) Show SMILES O=C(CCn1c2CCCCc2c(=O)[nH]c1=O)NCC(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C23H23N3O4/c27-20(17-10-9-15-5-1-2-6-16(15)13-17)14-24-21(28)11-12-26-19-8-4-3-7-18(19)22(29)25-23(26)30/h1-2,5-6,9-10,13H,3-4,7-8,11-12,14H2,(H,24,28)(H,25,29,30)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	800	n/a	n/a	n/a	n/a
Bayer AG Curated by ChEMBL					Assay Description Concentration required to inhibit human recombinant PARP-1 was determined using cell protection assay				Bioorg Med Chem Lett 12: 3187-90 (2002) BindingDB Entry DOI: 10.7270/Q2VX0FTT
					More data for this Ligand-Target Pair