BDBM50273601 4-[3-Methoxy-4-(pyridin-2-yloxy)phenyl]-4-quinolin-3-ylbutan-2-one::CHEMBL457216

SMILES: COc1cc(ccc1Oc1ccccn1)C(CC(C)=O)c1cnc2ccccc2c1

InChI Key: InChIKey=JBATWLGSNPAREQ-UHFFFAOYSA-N

Data: 6 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50273601   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
cAMP-specific 3',5'-cyclic phosphodiesterase 4D (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 KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of full length human PDE4D2 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
cGMP-specific 3',5'-cyclic phosphodiesterase (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 Reactome pathway 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 PDE5A1 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
Homo sapiens phosphodiesterase 2A (PDE2A) (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 UniProtKB/SwissProt 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 PDE2A3 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
Phosphodiesterase 7 (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 Reactome pathway 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 PDE7A1 catalytic domain 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
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 UniProtKB/TrEMBL 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
cAMP-specific 3',5'-cyclic phosphodiesterase 4D (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 KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
Georgia State University Curated by ChEMBL					Assay Description Inhibition of full length human PDE4D2 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