BDBM50038980 Benzo[1,3]dioxol-5-ylmethyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl-amine::CHEMBL63416

SMILES: C(Nc1ncnc2cc3OCOc3cc12)c1ccc2OCOc2c1

InChI Key: InChIKey=FKQAXLINOJNNLE-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 = 50038980   

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))	BDBM50038980 (Benzo[1,3]dioxol-5-ylmethyl-[1,3]dioxolo[4,5-g]qui...) Show SMILES C(Nc1ncnc2cc3OCOc3cc12)c1ccc2OCOc2c1 Show InChI InChI=1S/C17H13N3O4/c1-2-13-14(22-8-21-13)3-10(1)6-18-17-11-4-15-16(24-9-23-15)5-12(11)19-7-20-17/h1-5,7H,6,8-9H2,(H,18,19,20)	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	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Company Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against cGMP-phosphodiesterase from porcine aorta				J Med Chem 37: 2106-11 (1994) BindingDB Entry DOI: 10.7270/Q2Q52NPF
					More data for this Ligand-Target Pair