Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cGMP-specific 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50140588'   

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-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50140588 (5-ethyl-3-(4-methoxybenzyl)-(6aR,9aS)-3,4,5,8-tetr...) Show SMILES CCN1C2=N[C@@H]3CCC[C@@H]3N2c2ncn(Cc3ccc(OC)cc3)c2C1=O |r,t:3| Show InChI InChI=1S/C20H23N5O2/c1-3-24-19(26)17-18(25-16-6-4-5-15(16)22-20(24)25)21-12-23(17)11-13-7-9-14(27-2)10-8-13/h7-10,12,15-16H,3-6,11H2,1-2H3/t15-,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Lavras-UFLA Curated by ChEMBL					Assay Description Inhibition of PDE5				Eur J Med Chem 43: 1632-8 (2008) Article DOI: 10.1016/j.ejmech.2007.10.019 BindingDB Entry DOI: 10.7270/Q2Q81F9P
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50140588 (5-ethyl-3-(4-methoxybenzyl)-(6aR,9aS)-3,4,5,8-tetr...) Show SMILES CCN1C2=N[C@@H]3CCC[C@@H]3N2c2ncn(Cc3ccc(OC)cc3)c2C1=O |r,t:3| Show InChI InChI=1S/C20H23N5O2/c1-3-24-19(26)17-18(25-16-6-4-5-15(16)22-20(24)25)21-12-23(17)11-13-7-9-14(27-2)10-8-13/h7-10,12,15-16H,3-6,11H2,1-2H3/t15-,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory concentration against human phosphodiesterase 5 (PDE5) enzyme				Bioorg Med Chem Lett 14: 1291-4 (2004) Article DOI: 10.1016/j.bmcl.2003.12.027 BindingDB Entry DOI: 10.7270/Q2BG2NF0
					More data for this Ligand-Target Pair