Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase 1' and Ligand = 'BDBM214631'   

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))	BDBM214631 (US9283222, 762) Show SMILES CCN(CCNC(=O)c1c(F)cccc1F)C(=O)c1cc(Cc2n[nH]c(=O)c3CCCCc23)ccc1F Show InChI InChI=1S/C27H27F3N4O3/c1-2-34(13-12-31-26(36)24-21(29)8-5-9-22(24)30)27(37)19-14-16(10-11-20(19)28)15-23-17-6-3-4-7-18(17)25(35)33-32-23/h5,8-11,14H,2-4,6-7,12-13,15H2,1H3,(H,31,36)(H,33,35)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	8.0	n/a
AbbVie Inc. US Patent					Assay Description PARP1 assay was conducted in PARP assay buffer containing 50 mM Tris pH 8.0, 1 mM DTT, 4 mM MgCl2. PARP reactions contained 1.5 uM [3H]-NAD+ (1.6 uCi...				US Patent US9283222 (2016) BindingDB Entry DOI: 10.7270/Q2BZ64XD
					More data for this Ligand-Target Pair