Drug General Information
Drug ID	D09XOC
Former ID	DNC007845
Drug Name	3-bromo-1-(4-hexylphenyl)propan-1-one
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[529081]
Structure		Download 2D MOL 3D MOL
Formula	C15H21BrO
Canonical SMILES	CCCCCCC1=CC=C(C=C1)C(=O)CCBr
InChI	1S/C15H21BrO/c1-2-3-4-5-6-13-7-9-14(10-8-13)15(17)11-12-16/h7-10H,2-6,11-12H2,1H3
InChIKey	IKJXBCMGQCDIDG-UHFFFAOYSA-N
PubChem Compound ID	23635858
Target and Pathway
Target(s)	Thyroid hormone receptor beta-1	Target Info	Inhibitor	[529081]
	Thyroid hormone receptor alpha	Target Info	Inhibitor	[529081]
KEGG Pathway	Neuroactive ligand-receptor interaction
	Thyroid hormone signaling pathwayhsa04080:Neuroactive ligand-receptor interaction
	Thyroid hormone signaling pathway
Pathway Interaction Database	RXR and RAR heterodimerization with other nuclear receptorrxr_vdr_pathway:RXR and RAR heterodimerization with other nuclear receptor
Reactome	Nuclear Receptor transcription pathwayR-HSA-383280:Nuclear Receptor transcription pathway
WikiPathways	SIDS Susceptibility Pathways
	Hematopoietic Stem Cell Differentiation
	Nuclear ReceptorsWP474:Endochondral Ossification
	Nuclear Receptors
References
Ref 529081	J Med Chem. 2007 Nov 1;50(22):5269-80. Epub 2007 Oct 5.Inhibitors of the interaction of a thyroid hormone receptor and coactivators: preliminary structure-activity relationships.
Ref 529081	J Med Chem. 2007 Nov 1;50(22):5269-80. Epub 2007 Oct 5.Inhibitors of the interaction of a thyroid hormone receptor and coactivators: preliminary structure-activity relationships.

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