BDBM50041099 9-(3,3-Dimethyl-pentyl)-1,9-dihydro-purin-6-one::CHEMBL13159

SMILES: CCC(C)(C)CCn1cnc2c1nc[nH]c2=O

InChI Key: InChIKey=IKHLVJLISFXSJF-UHFFFAOYSA-N

Data: 1 KI

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 = 50041099   

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))	BDBM50041099 (9-(3,3-Dimethyl-pentyl)-1,9-dihydro-purin-6-one | ...) Show SMILES CCC(C)(C)CCn1cnc2c1nc[nH]c2=O Show InChI InChI=1S/C12H18N4O/c1-4-12(2,3)5-6-16-8-15-9-10(16)13-7-14-11(9)17/h7-8H,4-6H2,1-3H3,(H,13,14,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ciba-Geigy Corporation Curated by ChEMBL					Assay Description Inhibition of human erythrocytic PNP (purine nucleoside phosphorylase) in 1 mM phosphate				J Med Chem 37: 1109-14 (1994) BindingDB Entry DOI: 10.7270/Q2348JFD
					More data for this Ligand-Target Pair