Phakellin
| Internal ID | 6bedbf16-eb44-4d76-af3c-66042fcf283b |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acid derivatives > Carboxylic acid amides > 2-heteroaryl carboxamides |
| IUPAC Name | 3-amino-7,8-dibromo-5-hydroxy-2,4,6,12-tetrazatetracyclo[10.3.0.01,5.06,10]pentadeca-3,7,9-trien-11-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C11H11Br2N5O2/c12-5-4-6-8(19)17-3-1-2-10(17)11(20,16-9(14)15-10)18(6)7(5)13/h4,20H,1-3H2,(H3,14,15,16) |
| InChI Key | MZZHGEOLKCTPKO-UHFFFAOYSA-N |
| Popularity | 9 references in papers |
| Molecular Formula | C11H11Br2N5O2 |
| Molecular Weight | 405.05 g/mol |
| Exact Mass | 404.92590 g/mol |
| Topological Polar Surface Area (TPSA) | 95.90 Ų |
| XlogP | 0.30 |
| There are no found synonyms. |
| 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 |
|---|---|---|---|---|
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 97.12% | 94.45% |
| CHEMBL325 | Q13547 | Histone deacetylase 1 | 95.47% | 95.92% |
| CHEMBL284 | P27487 | Dipeptidyl peptidase IV | 95.44% | 95.69% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.19% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.92% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.48% | 95.56% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 92.32% | 93.99% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 91.53% | 94.75% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 91.50% | 90.00% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 89.40% | 92.94% |
| CHEMBL1829 | O15379 | Histone deacetylase 3 | 88.70% | 95.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.81% | 86.33% |
| CHEMBL238 | Q01959 | Dopamine transporter | 85.63% | 95.88% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 85.33% | 88.56% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 85.14% | 97.09% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 84.76% | 90.08% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 84.31% | 82.69% |
| CHEMBL228 | P31645 | Serotonin transporter | 84.09% | 95.51% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 83.99% | 90.71% |
| CHEMBL2581 | P07339 | Cathepsin D | 83.92% | 98.95% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 83.60% | 90.24% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 82.69% | 93.03% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 82.35% | 93.04% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 81.83% | 94.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.13% | 95.89% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 80.03% | 93.40% |
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 | 75180368 |
| LOTUS | LTS0222992 |
| wikiData | Q105176132 |