General
Preferred name
CELASTROL
Synonyms
Tripterin ()
Tripterine ()
Celastrol (NSC 70931) ()
P&D ID
PD002171
CAS
34157-83-0
Tags
drug candidate
natural product
available
Drug indication
Motor neurone disease
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)
DESCRIPTION
Celastrol is a plant-derived (from Tripterygium wilfordi, the Thunder god vine) natural product that has antioxidant, anti-inflammatory and anti-obesity effects . It has been reported as an inhibitor of RGS17 .
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
39
Organisms
1
Compound Sets
9
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
DrugMAP
Guide to Pharmacology
MedChem Express Bioactive Compound Library
NURSA ligand set
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Molecular Weight
450.28
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
5
Aromatic Ring Count
0
cLogP
6.7
TPSA
74.6
Fraction CSP3
0.66
Chiral centers
6.0
Largest ring
6.0
QED
0.47
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Proteases/Proteasome
Ubiquitination
Apoptosis
Autophagy
Metabolic Enzyme/Protease
Target
20S proteasome
Endogenous Metabolite
Mitophagy
Proteasome
Apoptosis related,Autophagy,Mitophagy,Proteasome
Source data
