BDBM50042771 7-[3-(4-Acetyl-3-hydroxy-2-propyl-phenoxy)-propoxy]-4-oxo-8-propyl-4H-chromene-2-carboxylic acid::CHEMBL123846

SMILES: CCCc1c(OCCCOc2ccc3c(oc(cc3=O)C(O)=O)c2CCC)ccc(C(C)=O)c1O

InChI Key: InChIKey=JHAGRZFIEACDNG-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50042771   

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
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50042771 (7-[3-(4-Acetyl-3-hydroxy-2-propyl-phenoxy)-propoxy...) Show SMILES CCCc1c(OCCCOc2ccc3c(oc(cc3=O)C(O)=O)c2CCC)ccc(C(C)=O)c1O Show InChI InChI=1S/C27H30O8/c1-4-7-19-22(11-9-17(16(3)28)25(19)30)33-13-6-14-34-23-12-10-18-21(29)15-24(27(31)32)35-26(18)20(23)8-5-2/h9-12,15,30H,4-8,13-14H2,1-3H3,(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Co. Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against cyclic GMP-phosphodiesterase (PDE V) isolated from porcine aorta.				J Med Chem 36: 3765-70 (1994) BindingDB Entry DOI: 10.7270/Q279459H
					More data for this Ligand-Target Pair