BDBM50046251 2-Amino-8-benzylamino-1,9-dihydro-purin-6-one::CHEMBL350429

SMILES: Nc1nc2nc(NCc3ccccc3)[nH]c2c(=O)[nH]1

InChI Key: InChIKey=QWCQVGUXEGLGMP-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 = 50046251   

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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50046251 (2-Amino-8-benzylamino-1,9-dihydro-purin-6-one | CH...) Show SMILES Nc1nc2nc(NCc3ccccc3)[nH]c2c(=O)[nH]1 Show InChI InChI=1S/C12H12N6O/c13-11-16-9-8(10(19)18-11)15-12(17-9)14-6-7-4-2-1-3-5-7/h1-5H,6H2,(H5,13,14,15,16,17,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.470	n/a	n/a	n/a	n/a	n/a	n/a
BioCryst Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of Purine nucleoside phosphorylase was evaluated against the enzyme from Human erythrocytic in 50 mM phosphate				J Med Chem 36: 55-69 (1993) BindingDB Entry DOI: 10.7270/Q2B27TCX
					More data for this Ligand-Target Pair