Drug General Information
Drug ID	D09JPC
Former ID	DNC011079
Drug Name	Hexane-1,6-diamine
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[530998]
Structure		Download 2D MOL 3D MOL
Formula	C6H16N2
Canonical SMILES	C(CCCN)CCN
InChI	1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2
InChIKey	NAQMVNRVTILPCV-UHFFFAOYSA-N
PubChem Compound ID	16402
Target and Pathway
Target(s)	Carbonic anhydrase	Target Info	Inhibitor	[530998]
	Carbonic anhydrase IV	Target Info	Inhibitor	[530998]
	Carbonic anhydrase I	Target Info	Inhibitor	[530998]
	Carbonic anhydrase VI	Target Info	Inhibitor	[530998]
	Carbonic anhydrase IX	Target Info	Inhibitor	[530998]
	Carbonic anhydrase XIV	Target Info	Inhibitor	[530998]
	Carbonic anhydrase XII	Target Info	Inhibitor	[530998]
KEGG Pathway	Nitrogen metabolism
	Proximal tubule bicarbonate reclamationhsa00910:Nitrogen metabolismhsa00910:Nitrogen metabolismhsa00910:Nitrogen metabolismhsa00910:Nitrogen metabolismhsa00910:Nitrogen metabolism
NetPath Pathway	TGF_beta_Receptor Signaling Pathway
Pathway Interaction Database	C-MYB transcription factor networkhif1_tfpathway:HIF-1-alpha transcription factor network
PathWhiz Pathway	Gastric Acid Production
Reactome	Erythrocytes take up carbon dioxide and release oxygen
	Erythrocytes take up oxygen and release carbon dioxide
	Reversible hydration of carbon dioxideR-HSA-1237044:Erythrocytes take up carbon dioxide and release oxygen
	Reversible hydration of carbon dioxideR-HSA-1475029:Reversible hydration of carbon dioxideR-HSA-1234158:Regulation of gene expression by Hypoxia-inducible Factor
	Reversible hydration of carbon dioxideR-HSA-1475029:Reversible hydration of carbon dioxideR-HSA-1475029:Reversible hydration of carbon dioxide
WikiPathways	Reversible Hydration of Carbon Dioxide
	Uptake of Carbon Dioxide and Release of Oxygen by Erythrocytes
	Uptake of Oxygen and Release of Carbon Dioxide by ErythrocytesWP2770:Reversible Hydration of Carbon Dioxide
	Uptake of Oxygen and Release of Carbon Dioxide by ErythrocytesWP2770:Reversible Hydration of Carbon DioxideWP2877:Vitamin D Receptor Pathway
	Regulation of Hypoxia-inducible Factor (HIF) by OxygenWP2770:Reversible Hydration of Carbon DioxideWP2770:Reversible Hydration of Carbon Dioxide
	miR-targeted genes in muscle cell - TarBase
	miR-targeted genes in leukocytes - TarBase
	miR-targeted genes in epithelium - TarBase
References
Ref 530998	J Med Chem. 2010 Aug 12;53(15):5511-22.Polyamines inhibit carbonic anhydrases by anchoring to the zinc-coordinated water molecule.
Ref 530998	J Med Chem. 2010 Aug 12;53(15):5511-22.Polyamines inhibit carbonic anhydrases by anchoring to the zinc-coordinated water molecule.

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