BindingDB PrimarySearch

BDBM50066454 CHEMBL25616::Sodium; 1-{4-[(benzo[1,3]dioxol-5-ylmethyl)-amino]-6-chloro-quinazolin-2-yl}-piperidine-4-carboxylate

SMILES: [O-]C(=O)C1CCN(CC1)c1nc(NCc2ccc3OCOc3c2)c2cc(Cl)ccc2n1

InChI Key: InChIKey=QUUJQFQTLSFCKW-UHFFFAOYSA-M

Data: 7 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50066454
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.60	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Company, Ltd. Curated by ChEMBL					Assay Description Inhibition of Phosphodiesterase 5 from porcine platelets				J Med Chem 41: 3367-72 (1998) Article DOI: 10.1021/jm970815r BindingDB Entry DOI: 10.7270/Q2MS3RXG
Eisai Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Canis lupus familiaris)	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 5 (PDE V), isolated from cardiac ventricle				J Med Chem 42: 1293-305 (1999) Article DOI: 10.1021/jm9807048 BindingDB Entry DOI: 10.7270/Q27P8XKH
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
Phosphodiesterase 1 (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 1 (PDE I), isolated from cardiac ventricle				J Med Chem 42: 1293-305 (1999) Article DOI: 10.1021/jm9807048 BindingDB Entry DOI: 10.7270/Q27P8XKH
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Company, Ltd. Curated by ChEMBL					Assay Description 50% inhibitory concentration against phosphodiesterase 5 (PDE5) from porcine platelets				J Med Chem 43: 2523-9 (2000) BindingDB Entry DOI: 10.7270/Q2T72J4N
Eisai Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
Phosphodiesterase 3 (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 3 (PDE 3) isolated from cardiac ventricle				J Med Chem 42: 1293-305 (1999) Article DOI: 10.1021/jm9807048 BindingDB Entry DOI: 10.7270/Q27P8XKH
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
Homo sapiens phosphodiesterase 2A (PDE2A) (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					Assay Description Inhibition of canine adrenal gland Phosphodiesterase 2				J Med Chem 42: 1293-305 (1999) Article DOI: 10.1021/jm9807048 BindingDB Entry DOI: 10.7270/Q27P8XKH
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair
Phosphodiesterase 4 (Homo sapiens (Human))	BDBM50066454 (CHEMBL25616 \| Sodium; 1-{4-[(benzo[1,3]dioxol-5-yl...) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					Assay Description Inhibition of canine lung Phosphodiesterase 4				J Med Chem 42: 1293-305 (1999) Article DOI: 10.1021/jm9807048 BindingDB Entry DOI: 10.7270/Q27P8XKH
Tanabe Seiyaku Company, Ltd. Curated by ChEMBL					More data for this Ligand-Target Pair