BDBM50145134 CHEMBL3764464

SMILES: Fc1ccc(cc1)C1Nc2cccc3c2c(n[nH]c3=O)C1c1nccs1

InChI Key: InChIKey=MZEQOWHGLGJDMY-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50145134   

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))	BDBM50145134 (CHEMBL3764464) Show SMILES Fc1ccc(cc1)C1Nc2cccc3c2c(n[nH]c3=O)C1c1nccs1 Show InChI InChI=1S/C19H13FN4OS/c20-11-6-4-10(5-7-11)16-15(19-21-8-9-26-19)17-14-12(18(25)24-23-17)2-1-3-13(14)22-16/h1-9,15-16,22H,(H,24,25)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	24	n/a	n/a	n/a	n/a
BioMarin Pharmaceutical Inc. Curated by ChEMBL					Assay Description Inhibition of PARP in human LoVo cells assessed as inhibition of poly(ADP)-ribose polymerization for 30 mins by fluorescence assay				J Med Chem 59: 335-57 (2016) BindingDB Entry DOI: 10.7270/Q2K35WJR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50145134 (CHEMBL3764464) Show SMILES Fc1ccc(cc1)C1Nc2cccc3c2c(n[nH]c3=O)C1c1nccs1 Show InChI InChI=1S/C19H13FN4OS/c20-11-6-4-10(5-7-11)16-15(19-21-8-9-26-19)17-14-12(18(25)24-23-17)2-1-3-13(14)22-16/h1-9,15-16,22H,(H,24,25)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.40	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