General
Preferred name
resatorvid
Synonyms
TAK 242 ()
TAK-242 ()
CLI-095 ()
P&D ID
PD013024
CAS
243984-11-4
243984-10-3
Tags
available
drug candidate
Drug indication
Sepsis
Drug Status
investigational
Max Phase
Phase 3
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 Resatorvid (TAK242) was first identified as an inhibitor of inflammatory mediator production in LPS treated mouse macrophages . Subsequent work found that this action was attributable to the compound's activity as a Toll-like receptor 4 (TLR4) antagonist . (GtoPdb)
DESCRIPTION Potent sepiapterin reductase (SPR) inhibitor; attenuates proliferation of CD4+ T cells (Tocris Bioactive Compound Library)
Cell lines
1
Organisms
0
Compound Sets
16
Cayman Chemical Bioactives
13871
ChEMBL Drugs
CHEMBL225157
Concise Guide to Pharmacology 2017/18
9036
Concise Guide to Pharmacology 2019/20
9036
Concise Guide to Pharmacology 2021/22
9036
Concise Guide to Pharmacology 2023/24
9036
Drug Repurposing Hub
DrugBank
DB05943
DrugMAP
DMFMWYC
EU-OPENSCREEN Bioactive Compound Library
EOS101175
Guide to Pharmacology
9036
Mcule NIBR MoA Box Subset
MCULE-8159223642
MedChem Express Bioactive Compound Library
HY-11109
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
Tocris Bioactive Compound Library
6587
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
361.06
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
5
Ring Count
2
Aromatic Ring Count
1
cLogP
3.26
TPSA
72.47
Fraction CSP3
0.4
Chiral centers
1.0
Largest ring
6.0
QED
0.82
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Primary Target
Toll-like Receptors
MOA
Inhibitor
toll-like receptor inhibitor
Member status
member
Target
TLR4
Interleukin Related
TNF Receptor
Toll-like Receptor (TLR)
Pathway
Apoptosis
Autophagy
Immunology/Inflammation
Source data