BDBM50120250 1-[4-(4-Pyrimidin-2-yl-piperazin-1-yl)-butyl]-5,6,7,8-tetrahydro-1H-quinazoline-2,4-dione::CHEMBL110682

SMILES: O=c1[nH]c(=O)n(CCCCN2CCN(CC2)c2ncccn2)c2CCCCc12

InChI Key: InChIKey=ZMYHFZAJCCTFDP-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50120250   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50120250 (1-[4-(4-Pyrimidin-2-yl-piperazin-1-yl)-butyl]-5,6,...) Show SMILES O=c1[nH]c(=O)n(CCCCN2CCN(CC2)c2ncccn2)c2CCCCc12 Show InChI InChI=1S/C20H28N6O2/c27-18-16-6-1-2-7-17(16)26(20(28)23-18)11-4-3-10-24-12-14-25(15-13-24)19-21-8-5-9-22-19/h5,8-9H,1-4,6-7,10-15H2,(H,23,27,28)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+3	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