Compound Detail
CHEMBL4297588
ODEVIXIBAT 💊 Approved Drug
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💊 Approved Drug
CCCCC1(CCCC)CN(c2ccccc2)c2cc(SC)c(OCC(=O)N[C@@H](C(=O)N[C@@H](CC)C(=O)O)c3ccc(O)cc3)cc2S(=O)(=O)N1
Basic Information
| ChEMBL ID | CHEMBL4297588 |
| Name | ODEVIXIBAT |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | XULSCZPZVQIMFM-IPZQJPLYSA-N |
| Therapeutic | ✓ Yes |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
6
Known Names
6
Indications
1
Mechanisms
Molecular Properties
740.9
MW (Da)
5.88
ALogP
9
HBA
5
HBD
174.4
PSA (Ų)
0.11
QED
2
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 2021 |
| Availability | Prescription |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Ileal bile acid transporter inhibitor | INHIBITOR | Ileal sodium/bile acid cotransporter | ✓ | ✓ |
Indications
Cholestasis, Intrahepatic Alagille Syndrome Biliary Atresia Cholestasis Liver Cirrhosis, Biliary Non-alcoholic Fatty Liver Disease
ATC Classification
A05AX05
odevixibat
Level 1: ALIMENTARY TRACT AND METABOLISM
Level 2: BILE AND LIVER THERAPY
Activity Summary
IC50 3 meas. best 9.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bile acid receptor CHEMBL2047 | IC50 | 9.8 | 9.8 | 0.2 | 1 |
| Unchecked CHEMBL612545 | IC50 | 9.8 | 9.8 | 0.2 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bile acid receptor | IC50 | = | 0.16 | nM | 9.8 | Glycocholic acid Uptake Radiometric Assay: ISBT Hu HEK Uptake SPA 13203 IBAT HUM... | - |
| Unchecked | IC50 | = | 0.16 | nM | 9.8 | Pharmaceutical Effect Mean Inhibitory Effect: ISBT Hu HEK Uptake SPA 13203 IBAT ... | - |
| Unchecked | IC50 | = | 0.16 | nM | 9.8 | Pharmaceutical Effect Mean Inhibitory Effect: ISBT Hu HEK Uptake SPA 13203 IBAT ... | - |
Data from ChEMBL 36 via Core Engine