BDBM50145144 CHEMBL3764951

SMILES: CC(=O)Nc1ccc(cc1)C1Nc2cc(F)cc3c2c(n[nH]c3=O)C1c1ncnn1C

InChI Key: InChIKey=LDOZYNZAILTQCF-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 = 50145144   

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))	BDBM50145144 (CHEMBL3764951) Show SMILES CC(=O)Nc1ccc(cc1)C1Nc2cc(F)cc3c2c(n[nH]c3=O)C1c1ncnn1C Show InChI InChI=1S/C21H18FN7O2/c1-10(30)25-13-5-3-11(4-6-13)18-17(20-23-9-24-29(20)2)19-16-14(21(31)28-27-19)7-12(22)8-15(16)26-18/h3-9,17-18,26H,1-2H3,(H,25,30)(H,28,31)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
BioMarin Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of human PARP1 using [3H]NAD as substrate after 1 min by microplate scintillation counting analysis				J Med Chem 59: 335-57 (2016) BindingDB Entry DOI: 10.7270/Q2K35WJR
					More data for this Ligand-Target Pair