Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with all data for assayid = 4 entry = 50027751   

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
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A (Homo sapiens (Human))	BDBM50273983 (1-[3-Methoxy-4-(pyridin-2-yloxy)phenyl]-1-quinolin...) Show SMILES CCCC(O)(c1ccc(Oc2ccccn2)c(OC)c1)c1cnc2ccccc2c1 Show InChI InChI=1S/C25H24N2O3/c1-3-13-25(28,20-15-18-8-4-5-9-21(18)27-17-20)19-11-12-22(23(16-19)29-2)30-24-10-6-7-14-26-24/h4-12,14-17,28H,3,13H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of human cloned PDE9A2 expressed in Escherichia coli BL21 by liquid scintillation counting				J Med Chem 51: 7673-88 (2008) Article DOI: 10.1021/jm701635j BindingDB Entry DOI: 10.7270/Q2736QRN
					More data for this Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A (Homo sapiens (Human))	BDBM50273601 (4-[3-Methoxy-4-(pyridin-2-yloxy)phenyl]-4-quinolin...) Show SMILES COc1cc(ccc1Oc1ccccn1)C(CC(C)=O)c1cnc2ccccc2c1 Show InChI InChI=1S/C25H22N2O3/c1-17(28)13-21(20-14-19-7-3-4-8-22(19)27-16-20)18-10-11-23(24(15-18)29-2)30-25-9-5-6-12-26-25/h3-12,14-16,21H,13H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of human cloned PDE9A2 expressed in Escherichia coli BL21 by liquid scintillation counting				J Med Chem 51: 7673-88 (2008) Article DOI: 10.1021/jm701635j BindingDB Entry DOI: 10.7270/Q2736QRN
					More data for this Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A (Homo sapiens (Human))	BDBM50273512 (1-[4-Difluoromethoxy-3-(tetrahydrofuran-3-yloxy)ph...) Show SMILES CC(C)CC(=O)c1ccc(OC(F)F)c(OC2CCOC2)c1 Show InChI InChI=1S/C16H20F2O4/c1-10(2)7-13(19)11-3-4-14(22-16(17)18)15(8-11)21-12-5-6-20-9-12/h3-4,8,10,12,16H,5-7,9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of human cloned PDE9A2 expressed in Escherichia coli BL21 by liquid scintillation counting				J Med Chem 51: 7673-88 (2008) Article DOI: 10.1021/jm701635j BindingDB Entry DOI: 10.7270/Q2736QRN
					More data for this Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A (Homo sapiens (Human))	BDBM50273333 (1-[4-Methoxy-3-(tetrahydropyran-4-yloxy)phenyl]but...) Show SMILES CCCC(=O)c1ccc(OC)c(OC2CCOCC2)c1 Show InChI InChI=1S/C16H22O4/c1-3-4-14(17)12-5-6-15(18-2)16(11-12)20-13-7-9-19-10-8-13/h5-6,11,13H,3-4,7-10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of human cloned PDE9A2 expressed in Escherichia coli BL21 by liquid scintillation counting				J Med Chem 51: 7673-88 (2008) Article DOI: 10.1021/jm701635j BindingDB Entry DOI: 10.7270/Q2736QRN
					More data for this Ligand-Target Pair