Drug General Information
Drug ID	D0Q3GG
Former ID	DNC008596
Drug Name	AG-213
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[529134]
Structure		Download 2D MOL 3D MOL
Formula	C10H8N2O2S
Canonical SMILES	C1=CC(=O)C(=CC1=CC(=C(N)S)C#N)O
InChI	1S/C10H8N2O2S/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,14-15H,12H2/b6-3+,10-7+
InChIKey	CTSHLCWTPAQAAB-HCUSPQTFSA-N
PubChem Compound ID	5328803
Target and Pathway
Target(s)	Epidermal growth factor receptor	Target Info	Inhibitor	[529134]
	mRNA of HER2	Target Info	Inhibitor	[529134]
KEGG Pathway	MAPK signaling pathway
	ErbB signaling pathway
	Ras signaling pathway
	Rap1 signaling pathway
	Calcium signaling pathway
	Cytokine-cytokine receptor interaction
	HIF-1 signaling pathway
	FoxO signaling pathway
	Endocytosis
	PI3K-Akt signaling pathway
	Dorso-ventral axis formation
	Focal adhesion
	Adherens junction
	Gap junction
	Regulation of actin cytoskeleton
	GnRH signaling pathway
	Estrogen signaling pathway
	Oxytocin signaling pathway
	Epithelial cell signaling in Helicobacter pylori infection
	Hepatitis C
	Pathways in cancer
	Proteoglycans in cancer
	MicroRNAs in cancer
	Pancreatic cancer
	Endometrial cancer
	Glioma
	Prostate cancer
	Melanoma
	Bladder cancer
	Non-small cell lung cancer
	Central carbon metabolism in cancer
	Choline metabolism in cancerhsa04012:ErbB signaling pathway
NetPath Pathway	IL4 Signaling Pathway
	EGFR1 Signaling PathwayNetPath_11:TCR Signaling Pathway
PANTHER Pathway	Cadherin signaling pathway
	EGF receptor signaling pathwayP00012:Cadherin signaling pathway
	EGF receptor signaling pathway
Pathway Interaction Database	LPA receptor mediated events
	Signaling events mediated by PTP1B
	Arf6 signaling events
	Signaling events mediated by TCPTP
	Thromboxane A2 receptor signaling
	SHP2 signaling
	Regulation of Telomerase
	EGF receptor (ErbB1) signaling pathway
	EGFR-dependent Endothelin signaling events
	Posttranslational regulation of adherens junction stability and dissassembly
	Direct p53 effectors
	ErbB1 downstream signaling
	Urokinase-type plasminogen activator (uPA) and uPAR-mediated signaling
	E-cadherin signaling in keratinocytes
	ErbB receptor signaling network
	Internalization of ErbB1
	Stabilization and expansion of the E-cadherin adherens junction
	a6b1 and a6b4 Integrin signaling
	Syndecan-3-mediated signaling eventserbb4_pathway:ErbB4 signaling events
	ErbB2/ErbB3 signaling events
	Validated targets of C-MYC transcriptional repression
PathWhiz Pathway	Phosphatidylinositol Phosphate Metabolism
Reactome	Constitutive Signaling by Ligand-Responsive EGFR Cancer Variants
	SHC1 events in ERBB2 signaling
	PLCG1 events in ERBB2 signaling
	PIP3 activates AKT signaling
	GRB2 events in EGFR signaling
	GAB1 signalosome
	SHC1 events in EGFR signaling
	EGFR downregulation
	GRB2 events in ERBB2 signaling
	PI3K events in ERBB2 signaling
	EGFR Transactivation by Gastrin
	Constitutive Signaling by Aberrant PI3K in Cancer
	Constitutive Signaling by EGFRvIII
	RAF/MAP kinase cascadeR-HSA-1250196:SHC1 events in ERBB2 signaling
	Sema4D induced cell migration and growth-cone collapse
	RAF/MAP kinase cascade
WikiPathways	ErbB Signaling Pathway
	Regulation of Actin Cytoskeleton
	EGF/EGFR Signaling Pathway
	MAPK Signaling Pathway
	Focal Adhesion
	Aryl Hydrocarbon Receptor Pathway
	Extracellular vesicle-mediated signaling in recipient cells
	TCA Cycle Nutrient Utilization and Invasiveness of Ovarian Cancer
	Hair Follicle Development: Cytodifferentiation (Part 3 of 3)
	Bladder Cancer
	Hair Follicle Development: Induction (Part 1 of 3)
	Signaling by ERBB4
	Signaling by ERBB2
	Gastrin-CREB signalling pathway via PKC and MAPK
	PIP3 activates AKT signaling
	Nanoparticle-mediated activation of receptor signaling
	Aryl Hydrocarbon Receptor
	Spinal Cord Injury
	Integrated Pancreatic Cancer Pathway
	Gastric cancer network 2
	AGE/RAGE pathway
	Signaling Pathways in Glioblastoma
	Arylhydrocarbon receptor (AhR) signaling pathway
	miR-targeted genes in muscle cell - TarBase
	miR-targeted genes in lymphocytes - TarBase
	miR-targeted genes in epithelium - TarBase
	Integrated Breast Cancer Pathway
	Signaling by EGFR
	L1CAM interactionsWP710:DNA Damage Response (only ATM dependent)
	Leptin signaling pathway
	Semaphorin interactions
References
Ref 529134	Eur J Med Chem. 2008 Jul;43(7):1478-88. Epub 2007 Sep 29.Syntheses of 4-(indole-3-yl)quinazolines: a new class of epidermal growth factor receptor tyrosine kinase inhibitors.
Ref 529134	Eur J Med Chem. 2008 Jul;43(7):1478-88. Epub 2007 Sep 29.Syntheses of 4-(indole-3-yl)quinazolines: a new class of epidermal growth factor receptor tyrosine kinase inhibitors.

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