BDBM50385904 CHEMBL2041589

SMILES: COc1cc(cc(OC)c1OC)C(=O)OCc1ccc(o1)-c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=FWNWCOVZKQLXHD-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 = 50385904   

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 7 (Homo sapiens (Human))	BDBM50385904 (CHEMBL2041589) Show SMILES COc1cc(cc(OC)c1OC)C(=O)OCc1ccc(o1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C21H19NO8/c1-26-18-10-14(11-19(27-2)20(18)28-3)21(23)29-12-16-8-9-17(30-16)13-4-6-15(7-5-13)22(24)25/h4-11H,12H2,1-3H3	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	3.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Qu£mica M£dica (CSIC) Curated by ChEMBL					Assay Description Inhibition of human recombinant PDE7A1-mediated [3H]cAMP hydrolysis after 20 mins by scintillation proximity assay				J Med Chem 55: 3274-84 (2012) Article DOI: 10.1021/jm201720d BindingDB Entry DOI: 10.7270/Q2ZS2XJB
					More data for this Ligand-Target Pair