Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-specific 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50165786'   

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))	BDBM50165786 ((R)-2,7-Dibenzyl-5-ethyl-3-(4-hydroxy-benzyl)-7,8-...) Show SMILES CCN1C2=N[C@H](Cc3ccccc3)CN2c2nc(Cc3ccccc3)n(Cc3ccc(O)cc3)c2C1=O |t:3| Show InChI InChI=1S/C30H29N5O2/c1-2-33-29(37)27-28(35-20-24(31-30(33)35)17-21-9-5-3-6-10-21)32-26(18-22-11-7-4-8-12-22)34(27)19-23-13-15-25(36)16-14-23/h3-16,24,36H,2,17-20H2,1H3/t24-/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	29	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of human phosphodiesterase 5				Bioorg Med Chem Lett 15: 2365-9 (2005) Article DOI: 10.1016/j.bmcl.2005.02.083 BindingDB Entry DOI: 10.7270/Q2TM79MQ
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