General
Preferred name
LICOFELONE
Synonyms
ML-3000 ()
ML3000 ()
Licofelone (ML3000) ()
Licofelona ()
Ml 3000 ()
P&D ID
PD008717
CAS
156897-06-2
Tags
available
drug candidate
Drug indication
Osteoarthritis
Drug Status
investigational
Max Phase
2.0
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Licofelone (ML-3000) is a dual COX/5-lipoxygenase (5-LOX) inhibitor (IC50=0.21/0.18 ¦ÌM, respectively) for the treatment of osteoarthritis. Licofelone exerts anti-inflammatory and anti-proliferative effects. Licofelone induces apoptosis, and decreases the production of proinflammatory leukotrienes and prostaglandins[1][2][3].
PRICE 180
DESCRIPTION Licofelone (ML-3000) is a dual COX/LOX inhibitor potentially for treating osteoarthritis, acting as both an analgesic and anti-inflammatory. By inhibiting 5-LOX, it may reduce the gastrointestinal toxicity associated with other non-steroidal anti-inflammatory drugs, which only inhibit COX (cyclooxygenase). (TargetMol Bioactive Compound Library)
Cell lines
4
Organisms
1
Compound Sets
11
AdooQ Bioactive Compound Library
A11697
Cayman Chemical Bioactives
10007692
ChEMBL Drugs
CHEMBL300982
Drug Repurposing Hub
DrugBank
DB04725
DrugMAP
DM7HLFD
DrugMatrix
MedChem Express Bioactive Compound Library
HY-B1452
ReFrame library
Selleckchem Bioactive Compound Library
licofelone
TargetMol Bioactive Compound Library
T6568
External IDs
30
Properties
(calculated by RDKit )
Molecular Weight
379.13
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
5.68
TPSA
42.23
Fraction CSP3
0.26
Chiral centers
0.0
Largest ring
6.0
QED
0.63
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
5-LOX
Apoptosis
COX
Lipoxygenase
ALOX5, PLA2G2E, PTGS2
MOA
cyclooxygenase inhibitor, lipoxygenase inhibitor
Pathway
Immunology/Inflammation
Metabolism
Neuroscience
Metabolic Enzyme/Protease
Source data