Drug General Information
Drug ID	D0H0WD
Former ID	DNC011252
Drug Name	3-isobutoxy-9H-pyrido[3,4-b]indole
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[531188]
Structure		Download 2D MOL 3D MOL
Formula	C15H16N2O
Canonical SMILES	CC(C)COC1=NC=C2C(=C1)C3=CC=CC=C3N2
InChI	1S/C15H16N2O/c1-10(2)9-18-15-7-12-11-5-3-4-6-13(11)17-14(12)8-16-15/h3-8,10,17H,9H2,1-2H3
InChIKey	KWHWSXISOMCUPZ-UHFFFAOYSA-N
PubChem Compound ID	10333698
Target and Pathway
Target(s)	Gamma-aminobutyric-acid receptor alpha-5 subunit	Target Info	Inhibitor	[531188]
	Gamma-aminobutyric acid receptor	Target Info	Inhibitor	[531188]
	Gamma-aminobutyric acid receptor subunit gamma-2	Target Info	Inhibitor	[531188]
	Gamma-aminobutyric acid receptor subunit alpha-1	Target Info	Inhibitor	[531188]
	Gamma-aminobutyric-acid receptor alpha-3 subunit	Target Info	Inhibitor	[531188]
	Gamma-aminobutyric-acid receptor alpha-2 subunit	Target Info	Inhibitor	[531188]
KEGG Pathway	Neuroactive ligand-receptor interaction
	Retrograde endocannabinoid signaling
	GABAergic synapse
	Morphine addiction
	Nicotine addictionhsa04080:Neuroactive ligand-receptor interaction
	Nicotine addiction
Reactome	Ligand-gated ion channel transport
	GABA A receptor activationR-HSA-975298:Ligand-gated ion channel transport
	GABA A receptor activation
WikiPathways	Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
	Iron uptake and transportWP2754:Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
	Iron uptake and transportWP706:SIDS Susceptibility Pathways
	Iron uptake and transport
References
Ref 531188	Bioorg Med Chem. 2010 Nov 1;18(21):7548-64. Epub 2010 Sep 29.Design, synthesis, and subtype selectivity of 3,6-disubstituted |A-carbolines at Bz/GABA(A)ergic receptors. SAR and studies directed toward agents for treatment of alcohol abuse.
Ref 531188	Bioorg Med Chem. 2010 Nov 1;18(21):7548-64. Epub 2010 Sep 29.Design, synthesis, and subtype selectivity of 3,6-disubstituted |A-carbolines at Bz/GABA(A)ergic receptors. SAR and studies directed toward agents for treatment of alcohol abuse.

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