Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with Target = 'Phosphodiesterase 2A (PDE2A2)'   

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
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86644 (BC11-38-2 | US9173884, BC11-38-2) Show SMILES CCC(C)Sc1nc2CCSc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C16H18N2OS2/c1-3-11(2)21-16-17-13-9-10-20-14(13)15(19)18(16)12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86643 (BC11-38-1 | US9173884, BC11-38-1) Show SMILES CCCCSc1nc2CCSc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C16H18N2OS2/c1-2-3-10-21-16-17-13-9-11-20-14(13)15(19)18(16)12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86642 (BC11-38 | US9173884, BC11-38) Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C15H16N2OS2/c1-2-9-20-15-16-12-8-10-19-13(12)14(18)17(15)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86645 (BC11-38-3 | US9173884, BC11-38-3) Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccc(C)cc1 Show InChI InChI=1S/C16H18N2OS2/c1-3-9-21-16-17-13-8-10-20-14(13)15(19)18(16)12-6-4-11(2)5-7-12/h4-7H,3,8-10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM60808 (BDBM86640 | US9173884, BC11-19) Show SMILES O=c1nc2sc3ccccc3n2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C15H9N3O2S/c19-13-16-14-18(11-8-4-5-9-12(11)21-14)15(20)17(13)10-6-2-1-3-7-10/h1-9H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86646 (BC11-38-4 | US9173884, BC11-38-4) Show SMILES CCCSc1nc2CCSc2c(=O)n1-c1ccccc1OC |(5.66,2.64,;4.32,3.41,;2.99,2.64,;1.65,3.41,;.32,2.64,;-1.01,3.41,;-2.35,2.64,;-3.81,3.12,;-4.72,1.87,;-3.81,.62,;-2.35,1.1,;-1.01,.33,;-1.01,-1.21,;.32,1.1,;1.65,.33,;2.99,1.1,;4.32,.33,;4.32,-1.21,;2.99,-1.98,;1.65,-1.21,;.32,-1.98,;.32,-3.52,)| Show InChI InChI=1S/C16H18N2O2S2/c1-3-9-22-16-17-11-8-10-21-14(11)15(19)18(16)12-6-4-5-7-13(12)20-2/h4-7H,3,8-10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM86639 (BC11-15 | US9173884, BC11-15) Show SMILES CCN(CC)C(=O)c1cc(nc2n(nc(C)c12)-c1ccccc1C)-c1cccs1 Show InChI InChI=1S/C23H24N4OS/c1-5-26(6-2)23(28)17-14-18(20-12-9-13-29-20)24-22-21(17)16(4)25-27(22)19-11-8-7-10-15(19)3/h7-14H,5-6H2,1-4H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair
Isoform PDE2A2 of cGMP-dependent 3',5'-cyclic phosphodiesterase (PDE2A2) (Homo sapiens (Human))	BDBM60812 (BDBM86641 | US9173884, BC11-28) Show SMILES Cc1ccccc1Nc1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(F)cc1 Show InChI InChI=1S/C25H19FN4/c1-17-7-5-6-10-22(17)29-24-23-21(18-8-3-2-4-9-18)15-30(25(23)28-16-27-24)20-13-11-19(26)12-14-20/h2-16H,1H3,(H,27,28,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Trustees of Boston College US Patent					Assay Description In vitro enzyme assays were conducted via the Ba(OH)2 precipitation method of Wang et al. (32) using recombinant human PDE11A4, PDE10A1, PDE5A1, PDE6...				US Patent US9173884 (2015) BindingDB Entry DOI: 10.7270/Q2PK0DZ6
					More data for this Ligand-Target Pair