BDBM50017092 4-(3-Isobutoxy-4-methoxy-phenyl)-pyrrolidin-2-one::CHEMBL416770

SMILES: COc1ccc(cc1OCC(C)C)C1CNC(=O)C1

InChI Key: InChIKey=AGQGSLHQIUKIEO-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50017092   

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
Phosphodiesterase 5A (Bos taurus)	BDBM50017092 (4-(3-Isobutoxy-4-methoxy-phenyl)-pyrrolidin-2-one ...) Show SMILES COc1ccc(cc1OCC(C)C)C1CNC(=O)C1 Show InChI InChI=1S/C15H21NO3/c1-10(2)9-19-14-6-11(4-5-13(14)18-3)12-7-15(17)16-8-12/h4-6,10,12H,7-9H2,1-3H3,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Neurochimie du CNRS Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase was determined in vitro using bovine aorta, at 1 uM cGMP for cGMP-PDE.				J Med Chem 32: 1450-7 (1989) BindingDB Entry DOI: 10.7270/Q2DN441H
					More data for this Ligand-Target Pair
Phosphodiesterase 1 (Bos taurus-BOVINE)	BDBM50017092 (4-(3-Isobutoxy-4-methoxy-phenyl)-pyrrolidin-2-one ...) Show SMILES COc1ccc(cc1OCC(C)C)C1CNC(=O)C1 Show InChI InChI=1S/C15H21NO3/c1-10(2)9-19-14-6-11(4-5-13(14)18-3)12-7-15(17)16-8-12/h4-6,10,12H,7-9H2,1-3H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Neurochimie du CNRS Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase was determined in vitro using bovine aorta, at 1 uM cGMP in the presence of calcium (10 uM) and calmodu...				J Med Chem 32: 1450-7 (1989) BindingDB Entry DOI: 10.7270/Q2DN441H
					More data for this Ligand-Target Pair
Phosphodiesterase 4 (Homo sapiens (Human))	BDBM50017092 (4-(3-Isobutoxy-4-methoxy-phenyl)-pyrrolidin-2-one ...) Show SMILES COc1ccc(cc1OCC(C)C)C1CNC(=O)C1 Show InChI InChI=1S/C15H21NO3/c1-10(2)9-19-14-6-11(4-5-13(14)18-3)12-7-15(17)16-8-12/h4-6,10,12H,7-9H2,1-3H3,(H,16,17)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Neurochimie du CNRS Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase was determined in vitro using bovine aorta, at 1 uM cAMP for cAMP-PDE.				J Med Chem 32: 1450-7 (1989) BindingDB Entry DOI: 10.7270/Q2DN441H
					More data for this Ligand-Target Pair