taurursodiol 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
5679 14605-22-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • taurursodiol
  • taurursodiol sodium
  • tauroursdeoxycholic acid
  • ursodoxicoltaurine
Relyvrio contains two active ingredients: sodium phenylbutyrate and taurursodiol, being indicated for the treatment of amyotrophic lateral sclerosis (ALS) in adults.The mechanism by which relyvrio exerts its therapeutic effects in patients with ALS is unknown.
  • Molecular weight: 499.71
  • Formula: C26H45NO6S
  • CLOGP: 2.07
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 4
  • TPSA: 123.93
  • ALOGS: -4.82
  • ROTB: 7

  • Status: OFM

  • Legend:
    OFP - off patent
    OFM - off market
    ONP - on patent

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2B,CDK5,EIF2AK3,ERBB2,GRK2,ITK,MAPK7,NTRK2,PDK1,PDK2,PDK4,PRKDC,TEK 13
kinase-selectivity-class EIF2AK3 1
pfas-class PFAS structural alert (1 = True, 0 = False) 0

Approvals:

DateAgencyCompanyOrphan
Sept. 29, 2022 FDA AMYLYX

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
ATC A05AA05 ALIMENTARY TRACT AND METABOLISM
BILE AND LIVER THERAPY
BILE THERAPY
Bile acids and derivatives
ATC N07XX19 NERVOUS SYSTEM
OTHER NERVOUS SYSTEM DRUGS
OTHER NERVOUS SYSTEM DRUGS
Other nervous system drugs
MeSH PA D000890 Anti-Infective Agents
MeSH PA D000998 Antiviral Agents
MeSH PA D002756 Cholagogues and Choleretics
MeSH PA D005765 Gastrointestinal Agents

Related Drugs by ATC class:

A05AA Bile acids and derivatives 4 drugs
N07XX Other nervous system drugs 23 drugs

Drug Use | Suggest Off label Use Form| |View source of the data|

DiseaseRelationSNOMED_IDDOID
Amyotrophic lateral sclerosis indication 86044005 DOID:332




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

None

Orange Book patent data (new drug applications)

Formulation strengthTrade nameApplicantApplication numberApproval dateTypeDose formRoutePatent numberPatent expiration datePatent use
3GM/PACKET; 1GM/PACKET RELYVRIO AMYLYX N216660 Sept. 29, 2022 DISCN FOR SUSPENSION ORAL 10251896 Dec. 24, 2033 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS (ALS) IN ADULTS
3GM/PACKET; 1GM/PACKET RELYVRIO AMYLYX N216660 Sept. 29, 2022 DISCN FOR SUSPENSION ORAL 10857162 Dec. 24, 2033 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS (ALS) IN ADULTS
3GM/PACKET; 1GM/PACKET RELYVRIO AMYLYX N216660 Sept. 29, 2022 DISCN FOR SUSPENSION ORAL 9872865 Dec. 24, 2033 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS (ALS) IN ADULTS

Orange Book exclusivity data (new drug applications)

Formulation strengthTrade nameApplicantApplication numberApproval dateTypeDose formRouteExclusivity dateDescription
3GM/PACKET; 1GM/PACKET RELYVRIO AMYLYX N216660 Sept. 29, 2022 DISCN FOR SUSPENSION ORAL Sept. 29, 2027 NEW CHEMICAL ENTITY
3GM/PACKET; 1GM/PACKET RELYVRIO AMYLYX N216660 Sept. 29, 2022 DISCN FOR SUSPENSION ORAL Sept. 29, 2029 TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS (ALS) IN ADULTS

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Bile acid receptor Nuclear hormone receptor IC50 4.17 CHEMBL
Phospholipase A2 Enzyme Kd 5 CHEMBL
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 Enzyme IC50 4.99 CHEMBL

External reference:

IDSource
5D5 PDB_CHEM_ID
CHEMBL272427 ChEMBL_ID
DB08834 DRUGBANK_ID
4041745 VANDF
C0075857 UMLSCUI
11388 INN_ID
35807-85-3 SECONDARY_CAS_RN
D11836 KEGG_DRUG
9848818 PUBCHEM_CID
40914 MMSL
40943 MMSL
d09918 MMSL
019092 NDDF
60EUX8MN5X UNII
2613950 RXNORM
C031655 MESH_SUPPLEMENTAL_RECORD_UI
60EUX8MN5X INXIGHT DRUGS

Pharmaceutical products:

None