General
Preferred name
URSOLIC ACID
Synonyms
Urosolic acid ()
Ursolic acid (Malol) ()
Prunol ()
Urson ()
Malol ()
NSC 167406, NSC-4060, Prunol, Urson, Malol ()
NSC-167406 ()
Micromerol ()
NSC-4060 ()
P&D ID
PD012044
CAS
209545-05-1
77-52-1
Tags
available
nuisance
drug candidate
probe
Drug indication
Metabolic syndrome x
Metabolic syndrome
Drug Status
investigational
experimental
Max Phase
2.0
Probe info
Probe type
calculated probe
Probe sources
Probe targets
[[ compound.targets[t].gene_name ]]
Probe control
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
Ursolic acid (Prunol) is a natural pentacyclic triterpenoid carboxylic acid, exerts anti-tumor effects and is an effective compound for cancer prevention and therapy.
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
47
Organisms
11
Compound Sets
12
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
DrugMAP
LSP-MoA library (Laboratory of Systems Pharmacology)
MedChem Express Bioactive Compound Library
Nuisance compounds in cellular assays
Probe Miner (suitable probes)
ReFrame library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
38
Molecular Weight
456.36
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
5
Aromatic Ring Count
0
cLogP
7.09
TPSA
57.53
Fraction CSP3
0.9
Chiral centers
10.0
Largest ring
6.0
QED
0.41
Structural alerts
1
Nonspecific/NOS
IMP
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
MOA
Autophagy
ATPase inhibitor, NFkB pathway inhibitor, STAT inhibitor
Target
HSD11B1, PLA2G1B, PTPN1, PYGM
Endogenous Metabolite
Pathway
Metabolic Enzyme/Protease
Source data
