Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Purine nucleoside phosphorylase' and Ligand = 'BDBM50041096'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Purine nucleoside phosphorylase (Rattus norvegicus)	BDBM50041096 (2-Amino-9-(5-mercapto-3,3-dimethyl-pentyl)-1,9-dih...) Show SMILES CC(C)(CCS)CCn1cnc2c1nc(N)[nH]c2=S Show InChI InChI=1S/C12H19N5S2/c1-12(2,4-6-18)3-5-17-7-14-8-9(17)15-11(13)16-10(8)19/h7,18H,3-6H2,1-2H3,(H3,13,15,16,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ciba-Geigy Corporation Curated by ChEMBL					Assay Description Inhibition of calf spleen 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
Purine nucleoside phosphorylase (Rattus norvegicus)	BDBM50041096 (2-Amino-9-(5-mercapto-3,3-dimethyl-pentyl)-1,9-dih...) Show SMILES CC(C)(CCS)CCn1cnc2c1nc(N)[nH]c2=S Show InChI InChI=1S/C12H19N5S2/c1-12(2,4-6-18)3-5-17-7-14-8-9(17)15-11(13)16-10(8)19/h7,18H,3-6H2,1-2H3,(H3,13,15,16,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ciba-Geigy Corporation Curated by ChEMBL					Assay Description Inhibition of calf spleen PNP (purine nucleoside phosphorylase) in 50 mM phosphate				J Med Chem 37: 1109-14 (1994) BindingDB Entry DOI: 10.7270/Q2348JFD
					More data for this Ligand-Target Pair