N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine — MultiTargetDB

Molecule Details

InChIKey	`QHIMVPIOWKYPSO-UHFFFAOYSA-N`
Compound Name	N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
Canonical SMILES	`COc1cc2c(Nc3c(Cl)ccc4c3OCO4)ncnc2cc1OCCCN1CCCCC1`
Clinical Status	Clinical Multi-Target
Targets (Human+Pathogen)	2
Pfam Stratification	Homologous
Avg pChEMBL	6.71
Source	ChEMBL;BindingDB;TTD_MultiTarget

2D Structure

2D structure

Activity Profile

DrugBank Annotations

DrugBank ID	DB07249
Drug Name	N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
CAS Number	nan
Groups	experimental
ATC Codes	nan
Description	nan

Cross-references: BindingDB: 6219 CHEMBL169186 ChemSpider: 4487348 PDB: 7X1 PubChem:5330197 PubChem:99443720 ZINC: ZINC000003938356

Target Activities (2)

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
P12931	SRC	Homo sapiens	Human	PF07714 PF00017 PF00018	7.0	IC50	ChEMBL;BindingDB
P54760	EPHB4	Homo sapiens	Human	PF14575 PF25599 PF01404 PF07699 PF00041 PF07714 PF00536	6.5	IC50	ChEMBL;BindingDB

DrugBank Target Actions (1)

Target	Gene	Target Name	Action	Type
P54760	EPHB4	Ephrin type-B receptor 4	binder	targets