Details
Stereochemistry | RACEMIC |
Molecular Formula | C21H19NO3S |
Molecular Weight | 365.445 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC2=CC=C(C=C2C=C1)C(C)C(=O)OC3=CC=C(C=C3)C(N)=S
InChI
InChIKey=YCNMAPLPQYQJFC-UHFFFAOYSA-N
InChI=1S/C21H19NO3S/c1-13(21(23)25-18-8-5-14(6-9-18)20(22)26)15-3-4-17-12-19(24-2)10-7-16(17)11-15/h3-13H,1-2H3,(H2,22,26)
Molecular Formula | C21H19NO3S |
Molecular Weight | 365.445 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
DescriptionSources: http://www.antibethera.com/pipeline/atb-346/Curator's Comment: Description was created based on several sources, including
http://adisinsight.springer.com/drugs/800040845
https://www.ncbi.nlm.nih.gov/pubmed/27777130
Sources: http://www.antibethera.com/pipeline/atb-346/
Curator's Comment: Description was created based on several sources, including
http://adisinsight.springer.com/drugs/800040845
https://www.ncbi.nlm.nih.gov/pubmed/27777130
ATB-346, being developed by Antibe Therapeutics, a Toronto-based pharmaceutical company, is a hydrogen sulfide-releasing non-steroidal anti-inflammatory drug (NSAID) that inhibits COX and suppresses prostaglandin production. ATB-346 exhibits anti-inflammatory, analgesic, antinociceptive, immunomodulatory, and neuroprotective activities. In vivo, this compound attenuates zymosan-induced inflammation, nociception, and immune signaling. ATB-346 also prevents ligature-induced periodontal bone loss and pathologies, potentially by suppressing increases in pro-inflammatory cytokine levels. Additionally, ATB-346 decreases edema and improves neurological function in animal models of traumatic brain injury (TBI). ATB-346 completed Phase 1 clinical studies in Q1 2015. To better understand the metabolism of ATB-346, Antibe conducted a radiolabeled study in rats at Covance Laboratories that was completed in Q4 2015. Antibe received approval from Health Canada in March 2016 to conduct a Phase 2 trial of ATB-346 in patients with osteoarthritis of the knee. Preclinical studies of ATB-346 for the treatment intestinal cancer; malignant melanoma; periodontal disorders are in progress.
Originator
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL1075388 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27777130 |
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Conditions
Condition | Modality | Targets | Highest Phase | Product |
---|---|---|---|---|
Palliative | Unknown Approved UseUnknown |
Sample Use Guides
In Vivo Use Guide
Sources: http://www.antibethera.com/pipeline/atb-346/
250 mg once daily
Route of Administration:
Oral
In Vitro Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/27777130
Incubation of A375 cells with ATB-346 (100 uM) for 24, 48 or 72 h caused an inhibition of cell proliferation by 38.2%, 63.2% and 66%, respectively
Substance Class |
Chemical
Created
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Edited
Sat Dec 16 10:04:50 GMT 2023
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Record UNII |
3096O7WP53
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Record Status |
Validated (UNII)
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