Drug General Information
Drug ID	D00RLE
Former ID	DNC013017
Drug Name	4-(4-chlorobenzyl)-2-methylphthalazin-1(2H)-one
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[528062]
Structure		Download 2D MOL 3D MOL
Formula	C16H13ClN2O
Canonical SMILES	CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=C(C=C3)Cl
InChI	1S/C16H13ClN2O/c1-19-16(20)14-5-3-2-4-13(14)15(18-19)10-11-6-8-12(17)9-7-11/h2-9H,10H2,1H3
InChIKey	QZOXWSKLFOUEKD-UHFFFAOYSA-N
PubChem Compound ID	11522042
Target and Pathway
Target(s)	Alpha-1A adrenergic receptor	Target Info	Inhibitor	[528062]
	Alpha-1D adrenergic receptor	Target Info	Inhibitor	[528062]
KEGG Pathway	Calcium signaling pathway
	cGMP-PKG signaling pathway
	Neuroactive ligand-receptor interaction
	AMPK signaling pathway
	Adrenergic signaling in cardiomyocytes
	Vascular smooth muscle contraction
	Salivary secretionhsa04020:Calcium signaling pathway
	Salivary secretion
NetPath Pathway	IL2 Signaling Pathway
PANTHER Pathway	Alpha adrenergic receptor signaling pathway
Reactome	Adrenoceptors
	G alpha (q) signalling events
	G alpha (12/13) signalling eventsR-HSA-390696:Adrenoceptors
	G alpha (12/13) signalling events
WikiPathways	Monoamine GPCRs
	Calcium Regulation in the Cardiac Cell
	GPCRs, Class A Rhodopsin-like
	Gastrin-CREB signalling pathway via PKC and MAPK
	Endothelin Pathways
	GPCR ligand binding
	GPCR downstream signaling
	AMPK SignalingWP58:Monoamine GPCRs
	GPCRs, Other
References
Ref 528062	Bioorg Med Chem Lett. 2006 May 15;16(10):2786-90. Epub 2006 Mar 2.Vasorelaxant activity of phthalazinones and related compounds.
Ref 528062	Bioorg Med Chem Lett. 2006 May 15;16(10):2786-90. Epub 2006 Mar 2.Vasorelaxant activity of phthalazinones and related compounds.

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