Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM107799'   

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))	BDBM107799 (US8598155, 36) Show SMILES COc1ccc(-c2c(cnn2C)-c2nc(C)n3ncnc(N4CCC4)c23)c(F)c1 |(4.96,-4.08,;5.36,-2.59,;4.27,-1.5,;2.78,-1.9,;1.7,-.81,;2.09,.68,;1.01,1.77,;-.46,1.29,;-1.36,2.54,;-.46,3.78,;1.01,3.31,;2.34,4.08,;-1.23,-.04,;-.32,-1.29,;-1.23,-2.53,;-.46,-3.87,;-2.69,-2.06,;-4.03,-2.83,;-5.36,-2.06,;-5.36,-.52,;-4.03,.25,;-4.03,1.79,;-2.94,2.88,;-4.03,3.97,;-5.12,2.88,;-2.69,-.52,;3.58,1.08,;3.98,2.56,;4.67,-.01,)| Show InChI InChI=1S/C20H20FN7O/c1-12-25-17(19-20(27-7-4-8-27)22-11-24-28(12)19)15-10-23-26(2)18(15)14-6-5-13(29-3)9-16(14)21/h5-6,9-11H,4,7-8H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.825	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. US Patent					Assay Description The activity of the test substances on human full-length PDE2A3 enzyme was determined using the [3H]-cGMP scintillation proximity assay (SPA) modifie...				US Patent US8598155 (2013) BindingDB Entry DOI: 10.7270/Q26T0K8C
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