Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0JQ1T
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| Former ID |
DNC012488
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| Drug Name |
2-[4-(1H-Indol-5-yl)-phenyl]-propionic acid
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| Synonyms |
CHEMBL104592; 2-[4-(1H-Indol-5-yl)-phenyl]-propionic acid; BDBM50074934; 2-[4-(1H-Indole-5-yl)phenyl]propanoic acid
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C17H15NO2
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| Canonical SMILES |
CC(C1=CC=C(C=C1)C2=CC3=C(C=C2)NC=C3)C(=O)O
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| InChI |
1S/C17H15NO2/c1-11(17(19)20)12-2-4-13(5-3-12)14-6-7-16-15(10-14)8-9-18-16/h2-11,18H,1H3,(H,19,20)
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| InChIKey |
NSKFZVRZALCZND-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Prostaglandin G/H synthase 1 (COX-1) | Target Info | Inhibitor | [1] |
| BioCyc | C20 prostanoid biosynthesis | |||
| KEGG Pathway | Arachidonic acid metabolism | |||
| Metabolic pathways | ||||
| Platelet activation | ||||
| Serotonergic synapse | ||||
| NetPath Pathway | TGF_beta_Receptor Signaling Pathway | |||
| Panther Pathway | Inflammation mediated by chemokine and cytokine signaling pathway | |||
| Pathwhiz Pathway | Arachidonic Acid Metabolism | |||
| WikiPathways | Prostaglandin Synthesis and Regulation | |||
| Arachidonic acid metabolism | ||||
| Phase 1 - Functionalization of compounds | ||||
| Eicosanoid Synthesis | ||||
| Selenium Micronutrient Network | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Structure-based design of COX-2 selectivity into flurbiprofen. Bioorg Med Chem Lett. 1999 Feb 8;9(3):307-12. | |||
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