Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50491680'   

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))	BDBM50491680 (CHEMBL2387429) Show SMILES COc1ccc(cc1-c1cnc(nc1)N1CCCCC1)C1=Nc2c(nn(CCO)c2C(=O)NC1)C(C)(C)C |t:23| Show InChI InChI=1S/C28H35N7O3/c1-28(2,3)25-23-24(35(33-25)12-13-36)26(37)29-17-21(32-23)18-8-9-22(38-4)20(14-18)19-15-30-27(31-16-19)34-10-6-5-7-11-34/h8-9,14-16,36H,5-7,10-13,17H2,1-4H3,(H,29,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PDE2 catalytic domain (unknown origin)				Bioorg Med Chem Lett 23: 3443-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.082 BindingDB Entry DOI: 10.7270/Q2C53PR1
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