General
Preferred name
SULFORAPHANE
Synonyms
L-Sulforaphane ()
(R)-Sulforaphane ()
Sfx-01 ()
4-(Methylsulfinyl)Butyl Isothiocyanate ()
(-)-sulforaphane ()
Sulforaphane, (r)- ()
P&D ID
PD019298
CAS
4478-93-7
142825-10-3
Tags
available
covalent binder
natural product
drug candidate
Drug indication
Skin disease
prostate adenocarcinoma
Solid tumour/cancer
Drug Status
investigational
Max Phase
3.0
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE
29
PRICE
110
DESCRIPTION
Sulforaphane is a natural isothiocyanate that activates Nrf2 and inhibits AMPK-dependent signaling. Sulforaphane has antitumor and anti-inflammatory activities by increasing the transcription of tumor suppressor proteins and inhibiting histone deacetylase activity.
DESCRIPTION
Found in cruciferous vegetables such as brocolli. It has potential chemopreventive , anti-cancer and neuroprotective actions . It may act as a quinone reductase inducer . Potential to modulate lipid dysregulation in obesity-related diseases is suggested by sulforaphane-mediated inhibition of the sterol regulatory element-binding protein (SREBs) transcription factors which regulate the expression of genes that are involved in fatty acid and cholesterol biosynthesis .
(GtoPdb)
DESCRIPTION
Sulforaphane is an isothiocyanate present naturally in widely consumed vegetables. Sulforaphane has anti-cancer and anti-inflammatory activities. It inhibits histone deacetylase activity (IC50= 631 nM for histone deacetylase 9) and activates Nrf2.
(Enamine Bioactive Compounds)
DESCRIPTION
Sulforaphaneis a naturally-occurring phytochemical belonging to the class of isothiocyanates. As the aglycone metabolite of glucosinolate glucoraphanin (sulforaphane glucosinolate), sulforaphane acts as an antioxidant and potent stimulator of endogenous detoxifying enzymes. This agent displays anticarcinogenic properties due to its ability to induce phase II detoxification enzymes, such as glutathione S-transferase and quinone reductase, thereby providing protection against certain carcinogens and toxic, reactive oxygen species. Broccoli sprouts contain large amounts of sulforaphane, which is also found in other cruciferous vegetables including cabbage and kale.
(BOC Sciences Bioactive Compounds)
DESCRIPTION
(R)-Sulforaphane (L-Sulforaphane) is a potent inducer of the Keap1/Nrf2/ARE pathway.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
28
Organisms
3
Compound Sets
11
BOC Sciences Bioactive Compounds
Cayman Chemical Bioactives
ChEMBL Drugs
CovalentInDB
DrugMAP
Enamine Bioactive Compounds
Guide to Pharmacology
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
30
Molecular Weight
177.03
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
5
Ring Count
0
Aromatic Ring Count
0
cLogP
1.25
TPSA
29.43
Fraction CSP3
0.83
Chiral centers
1.0
Largest ring
0.0
QED
0.36
Structural alerts
1
Other
Nrf2 activator
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Target
Keap1-Nrf2
Apoptosis
Bcl-2 Family
Caspase
HDAC
Reactive Oxygen Species (ROS)
HDAC,Heme Oxygenase,NF-¦ÊB,Nrf2,ROS
Pathway
NF-¦ÊB
Immunology/Inflammation
Cell Cycle/DNA Damage
Epigenetics
Metabolic Enzyme/Protease
NF-κB
Solubility
Soluble in Chloroform (Sparingly), Methanol (Slightly)
Source data
