Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50146552'   

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
cGMP-dependent 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50146552 (2-[7-Ethyl-6-(4-sulfamoyl-benzylamino)-7H-purin-2-...) Show SMILES CCOC(=O)c1sc(Nc2nc(NCc3ccc(cc3)S(N)(=O)=O)c3n(CC)cnc3n2)nc1C Show InChI InChI=1S/C21H24N8O4S2/c1-4-29-11-24-18-15(29)17(23-10-13-6-8-14(9-7-13)35(22,31)32)26-20(27-18)28-21-25-12(3)16(34-21)19(30)33-5-2/h6-9,11H,4-5,10H2,1-3H3,(H2,22,31,32)(H2,23,25,26,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of Phosphodiesterase 2				Bioorg Med Chem Lett 15: 1829-33 (2005) Article DOI: 10.1016/j.bmcl.2005.02.025 BindingDB Entry DOI: 10.7270/Q2W37X3W
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