Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cGMP-specific 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50050574'   

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))	BDBM50050574 (3-Methyl-6-(2-propoxy-phenyl)-1-(2,2,2-trifluoro-e...) Show SMILES CCCOc1ccccc1-c1nc2n(CC(F)(F)F)nc(C)c2c(=O)[nH]1 Show InChI InChI=1S/C17H17F3N4O2/c1-3-8-26-12-7-5-4-6-11(12)14-21-15-13(16(25)22-14)10(2)23-24(15)9-17(18,19)20/h4-7H,3,8-9H2,1-2H3,(H,21,22,25)	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	7	n/a	n/a	n/a	n/a	n/a	n/a
Laboratories Glaxo Wellcome Centre de Recherches Curated by ChEMBL					Assay Description Inhibition of Phosphodiesterase 5 from human				J Med Chem 39: 1635-44 (1996) Article DOI: 10.1021/jm950812j BindingDB Entry DOI: 10.7270/Q2057F1T
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Rattus norvegicus)	BDBM50050574 (3-Methyl-6-(2-propoxy-phenyl)-1-(2,2,2-trifluoro-e...) Show SMILES CCCOc1ccccc1-c1nc2n(CC(F)(F)F)nc(C)c2c(=O)[nH]1 Show InChI InChI=1S/C17H17F3N4O2/c1-3-8-26-12-7-5-4-6-11(12)14-21-15-13(16(25)22-14)10(2)23-24(15)9-17(18,19)20/h4-7H,3,8-9H2,1-2H3,(H,21,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a
Laboratories Glaxo Wellcome Centre de Recherches Curated by ChEMBL					Assay Description Compound was tested for inhibition of stimulation of rat aortic smooth muscle cells (RSMC)				J Med Chem 39: 1635-44 (1996) Article DOI: 10.1021/jm950812j BindingDB Entry DOI: 10.7270/Q2057F1T
					More data for this Ligand-Target Pair