Drug Information

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]
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 529081J 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 529081J 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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