Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase 2' and Ligand = 'BDBM50268268'   

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 2 (Homo sapiens (Human))	BDBM50268268 (CHEMBL4061458) Show SMILES Fc1ncc(Cn2c3ccccc3c(=O)[nH]c2=O)cc1NC(=O)[C@H]1CCN(CC2CC2)C1 |r| Show InChI InChI=1S/C23H24FN5O3/c24-20-18(26-21(30)16-7-8-28(13-16)11-14-5-6-14)9-15(10-25-20)12-29-19-4-2-1-3-17(19)22(31)27-23(29)32/h1-4,9-10,14,16H,5-8,11-13H2,(H,26,30)(H,27,31,32)/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Beijing Key Laboratory of Active Substance Discovery and Druggability Evaluation, Institute of Materia Medica, Chinese Academy of Medical Sciences& Peking Union Medical College, Beijing 100050, C Curated by ChEMBL					Assay Description Inhibition of recombinant human PARP-2 expressed in Escherichia coli BL21 (DE3) using sheared DNA as substrate in presence of biotinylated NAD after ...				Bioorg Med Chem 25: 4045-4054 (2017) Article DOI: 10.1016/j.bmc.2017.05.052 BindingDB Entry DOI: 10.7270/Q24Q7XFR
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