General
Preferred name
PF-8380
Synonyms
PF 8380 ()
PF-8380 (hydrochloride) ()
P&D ID
PD012872
CAS
1144035-53-9
2070015-01-7
Tags
available
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 PF-8380 is reported as a novel autotaxin inhibitor for use as a tool compound for investigating the in vivo role of autotaxin and LPA in inflammation and in cancer . An ATX inhibitor compound named PF-8380 is claimed in patent WO2011151461 , but this has a different chemical structure from the entity we depict here and whch was disclosed in St-Coeur et al.'s primary publication . (GtoPdb)
DESCRIPTION PF-8380 is a potent autotaxin inhibitor with an IC50 of 2.8 nM in isolated enzyme assay and 101 nM in human whole blood.
PRICE 31
DESCRIPTION PF-8380 hydrochloride is a potent autotaxin inhibitor with an IC50 of 2.8 nM in isolated enzyme assay and 101 nM in human whole blood.
DESCRIPTION Potent and selective GSK-3beta inhibitor (Tocris Bioactive Compound Library)
DESCRIPTION PF-8380 is an effective and orally available autotaxin inhibitor (IC50: 2.8 nM, in isolated enzyme assay; 101 nM, in the human whole blood). It modulates lysophosphatidic acid (LPA) levels in vivo/vitro by directly inhibiting autotaxin; reduces LPA levels both in plasma and at the site of inflammation. (TargetMol Bioactive Compound Library)
Cell lines
5
Organisms
0
Compound Sets
10
Axon Medchem Screening Library
Cayman Chemical Bioactives
Drug Repurposing Hub
EU-OPENSCREEN Bioactive Compound Library
Guide to Pharmacology
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
477.09
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
4
Aromatic Ring Count
3
cLogP
3.96
TPSA
95.85
Fraction CSP3
0.32
Chiral centers
0.0
Largest ring
6.0
QED
0.54
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
autotaxin
phosphodiesterase
ENPP2
ATX inhibitor
Phosphodiesterase (PDE)
PDE
Primary Target
Autotaxin
MOA
Inhibitor
Ectonucleotide Pyrophosphatase/Phosphodiesterase 2 (ENPP2
Autotaxin) Inhibitors
Autotaxin inhibitor
Member status
member
Pathway
Metabolism
Metabolic Enzyme/Protease
Source data