BDBM50120243 3-(2,4-Dioxo-3,4,5,6,7,8-hexahydro-2H-quinazolin-1-yl)-N-[2-oxo-2-(4-phenyl-piperazin-1-yl)-ethyl]-propionamide::3-(2,4-dioxo-3,4,5,6,7,8-hexahydroquinazolin-1(2H)yl)-N-(2-oxo-2-(4-phenylpiperazin-1-yl)ethyl)propanamide::CHEMBL322268

SMILES: O=C(CCn1c2CCCCc2c(=O)[nH]c1=O)NCC(=O)N1CCN(CC1)c1ccccc1

InChI Key: InChIKey=AMNBWMSOISLXPV-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50120243   

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))	BDBM50120243 (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)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H29N5O4/c29-20(10-11-28-19-9-5-4-8-18(19)22(31)25-23(28)32)24-16-21(30)27-14-12-26(13-15-27)17-6-2-1-3-7-17/h1-3,6-7H,4-5,8-16H2,(H,24,29)(H,25,31,32)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Huazhong University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of human recombinant PARP1				J Med Chem 52: 718-25 (2009) Article DOI: 10.1021/jm800902t BindingDB Entry DOI: 10.7270/Q2C53KPW
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50120243 (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)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H29N5O4/c29-20(10-11-28-19-9-5-4-8-18(19)22(31)25-23(28)32)24-16-21(30)27-14-12-26(13-15-27)17-6-2-1-3-7-17/h1-3,6-7H,4-5,8-16H2,(H,24,29)(H,25,31,32)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	200	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