Wakayin
| Internal ID | dae3c7a4-c104-4e6d-93d6-74739f655cde |
| Taxonomy | Organoheterocyclic compounds > Quinolines and derivatives > Pyrroloquinolines > Pyrrolo[4,3,2-de]quinolines |
| IUPAC Name | 3-(1H-indol-3-yl)-5,9,14-triazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,8(15),10-pentaen-7-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H14N4O/c25-20-18-15-10(7-23-18)5-6-21-17(15)16-13(9-24-19(16)20)12-8-22-14-4-2-1-3-11(12)14/h1-4,7-9,22-24H,5-6H2 |
| InChI Key | XUKANBLDSRNPMH-UHFFFAOYSA-N |
| Popularity | 10 references in papers |
| Molecular Formula | C20H14N4O |
| Molecular Weight | 326.40 g/mol |
| Exact Mass | 326.11676108 g/mol |
| Topological Polar Surface Area (TPSA) | 76.80 Ų |
| XlogP | 2.80 |
| CHEMBL458044 |
| 3-(1H-indol-3-yl)-5,9,14-triazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,8(15),10-pentaen-7-one |
| 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 |
|---|---|---|---|---|
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.56% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.86% | 98.95% |
| CHEMBL2095172 | P14867 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 94.58% | 92.67% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.53% | 91.11% |
| CHEMBL4302 | P08183 | P-glycoprotein 1 | 93.33% | 92.98% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 92.81% | 98.59% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 91.53% | 96.67% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 91.26% | 91.49% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 90.64% | 99.23% |
| CHEMBL2708 | Q16584 | Mitogen-activated protein kinase kinase kinase 11 | 90.58% | 81.14% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 89.81% | 96.39% |
| CHEMBL5443 | O00311 | Cell division cycle 7-related protein kinase | 89.55% | 96.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 88.75% | 89.00% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 87.55% | 88.56% |
| CHEMBL3155 | P34969 | Serotonin 7 (5-HT7) receptor | 87.45% | 90.71% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 86.48% | 93.99% |
| CHEMBL2094127 | P06493 | Cyclin-dependent kinase 1/cyclin B | 85.89% | 96.00% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 84.98% | 93.03% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 84.57% | 94.00% |
| CHEMBL1868 | P17948 | Vascular endothelial growth factor receptor 1 | 83.96% | 96.47% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 83.64% | 96.21% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 83.61% | 97.64% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 82.88% | 96.09% |
| CHEMBL4225 | P49760 | Dual specificity protein kinase CLK2 | 82.35% | 80.96% |
| CHEMBL3524 | P56524 | Histone deacetylase 4 | 81.37% | 92.97% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 80.74% | 96.77% |
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.
| There are no matching plants. |
| PubChem | 9973710 |
| LOTUS | LTS0032515 |
| wikiData | Q105342371 |