1-methoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid
| Internal ID | 37ee2a75-b995-4818-b356-bdf65673f295 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Pyridoindoles > Beta carbolines |
| IUPAC Name | 1-methoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid |
| SMILES (Canonical) | COC1=C2C(=CC(=N1)C(=O)O)C3=CC=CC=C3N2 |
| SMILES (Isomeric) | COC1=C2C(=CC(=N1)C(=O)O)C3=CC=CC=C3N2 |
| InChI | InChI=1S/C13H10N2O3/c1-18-12-11-8(6-10(15-12)13(16)17)7-4-2-3-5-9(7)14-11/h2-6,14H,1H3,(H,16,17) |
| InChI Key | IZGILNCXLRBSAJ-UHFFFAOYSA-N |
| Popularity | 1 reference in papers |
| Molecular Formula | C13H10N2O3 |
| Molecular Weight | 242.23 g/mol |
| Exact Mass | 242.06914219 g/mol |
| Topological Polar Surface Area (TPSA) | 75.20 Ų |
| XlogP | 2.50 |
| There are no found synonyms. |
![2D Structure of 1-methoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid](https://plantaedb.com/storage/docs/compounds/2023/11/1-methoxy-9h-pyrido34-bindole-3-carboxylic-acid.jpg "2D Structure of 1-methoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid")
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.99% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.34% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.87% | 95.56% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.17% | 99.23% |
| CHEMBL2535 | P11166 | Glucose transporter | 87.03% | 98.75% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 86.53% | 99.17% |
| CHEMBL2716 | Q8WUI4 | Histone deacetylase 7 | 86.37% | 89.44% |
| CHEMBL2581 | P07339 | Cathepsin D | 86.27% | 98.95% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 85.53% | 94.62% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.35% | 86.33% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 85.04% | 97.00% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 82.51% | 85.14% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 81.22% | 91.49% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 80.41% | 94.00% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 80.39% | 95.56% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| Taraxacum mongolicum |
| PubChem | 10999180 |
| LOTUS | LTS0039401 |
| wikiData | Q105123194 |