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Compound Detail

CHEMBL2107831

LUSUTROMBOPAG
💊 Approved Drug
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💊 Approved Drug
CCCCCCO[C@@H](C)c1cccc(-c2csc(NC(=O)c3cc(Cl)c(/C=C(\C)C(=O)O)c(Cl)c3)n2)c1OC

Basic Information

ChEMBL ID CHEMBL2107831
Name LUSUTROMBOPAG
Phase Approved
Structure Type MOL
InChI Key NOZIJMHMKORZBA-KJCUYJGMSA-N
Therapeutic ✓ Yes

Known Names

Lusutrombopag Mulpleo (previously lusutrombopag shionogi) Mulpleta RSC888711 S-888711
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
5
Known Names
3
Indications
1
Mechanisms

Molecular Properties

591.6
MW (Da)
8.52
ALogP
6
HBA
2
HBD
97.8
PSA (Ų)
0.15
QED
2
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2018
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Oral

Flags

Natural Product
USAN Stem -trombopag
USAN Year 2012

Extended Properties

Molecular Formula C29H32Cl2N2O5S
MW 591.56
Aromatic Rings 3
Heavy Atoms 39
NP-Likeness -0.73

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Thrombopoietin receptor agonist AGONIST Thrombopoietin receptor

Indications

Hemorrhage Thrombocytopenia Purpura, Thrombocytopenic, Idiopathic

ATC Classification

B02BX07
lusutrombopag
Level 1: BLOOD AND BLOOD FORMING ORGANS
Level 2: ANTIHEMORRHAGICS

Activity Summary

IC50 1 meas. best 5.42

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
SARS-CoV-2
CHEMBL4303835
IC50 5.42 5.42 3780.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
SARS-CoV-2 IC50 = 3780.0 nM 5.42 Antiviral activity against SARS-CoV-2 (viral titer) measured by plaque assay in ... -

Literature References

PubMed DOI Target Context # Activities
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 3
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 3
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 2
37468498 10.1038/s41467-023-40064-9 Sodium-dependent serotonin transporter 1
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M2 1
37468498 10.1038/s41467-023-40064-9 D(3) dopamine receptor 1
37468498 10.1038/s41467-023-40064-9 Vascular endothelial growth factor receptor 2 1
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 1
37468498 10.1038/s41467-023-40064-9 Amine oxidase [flavin-containing] A 1
37468498 10.1038/s41467-023-40064-9 Mu-type opioid receptor 1
37468498 10.1038/s41467-023-40064-9 Alpha-2A adrenergic receptor 1
- 10.1101/2020.03.20.999730 SARS-CoV-2 1
37468498 10.1038/s41467-023-40064-9 Acetylcholinesterase 1
37468498 10.1038/s41467-023-40064-9 Estrogen receptor 1
37468498 10.1038/s41467-023-40064-9 Bile salt export pump 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent dopamine transporter 1
37468498 10.1038/s41467-023-40064-9 Voltage-gated inwardly rectifying potassium channel KCNH2 1
- 10.1101/2020.03.20.999730 ADMET 1

Data from ChEMBL 36 via Core Engine