BDBM50238446 CHEMBL4073498

SMILES: CC(=O)Nc1ccc(Nc2nc3ccccc3n3nnnc23)cc1

InChI Key: InChIKey=RSXPJGBTXGYWJA-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 = 50238446   

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 tankyrase-1 (Homo sapiens (Human))	BDBM50238446 (CHEMBL4073498) Show SMILES CC(=O)Nc1ccc(Nc2nc3ccccc3n3nnnc23)cc1 Show InChI InChI=1S/C16H13N7O/c1-10(24)17-11-6-8-12(9-7-11)18-15-16-20-21-22-23(16)14-5-3-2-4-13(14)19-15/h2-9H,1H3,(H,17,24)(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
A GlaxoSmithKline Company Curated by ChEMBL					Assay Description Binding affinity to TNKS1 in human HeLa cell extract after 2 hrs by HTS assay				J Med Chem 60: 5455-5471 (2017) Article DOI: 10.1021/acs.jmedchem.7b00137 BindingDB Entry DOI: 10.7270/Q2X350RS
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50238446 (CHEMBL4073498) Show SMILES CC(=O)Nc1ccc(Nc2nc3ccccc3n3nnnc23)cc1 Show InChI InChI=1S/C16H13N7O/c1-10(24)17-11-6-8-12(9-7-11)18-15-16-20-21-22-23(16)14-5-3-2-4-13(14)19-15/h2-9H,1H3,(H,17,24)(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
A GlaxoSmithKline Company Curated by ChEMBL					Assay Description Inhibition of TNKS1 (unknown origin) expressed in HEK293 cells co-expressing TCF/LEF luciferase plasmid assessed as reduction in wnt3a ligand-induced...				J Med Chem 60: 5455-5471 (2017) Article DOI: 10.1021/acs.jmedchem.7b00137 BindingDB Entry DOI: 10.7270/Q2X350RS
					More data for this Ligand-Target Pair