5,6-bis(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-2-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxamide
| Internal ID | e0d600e8-4ae8-47f4-bf22-f692b47cba4f |
| Taxonomy | Phenylpropanoids and polyketides > Stilbenes |
| IUPAC Name | 5,6-bis(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-2-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C31H36N2O6/c1-19(2)16-32-30(34)29-23(31(35)33-12-4-3-5-13-33)9-8-22(20-6-10-24-26(14-20)38-17-36-24)28(29)21-7-11-25-27(15-21)39-18-37-25/h6-11,14-15,19,22-23,28-29H,3-5,12-13,16-18H2,1-2H3,(H,32,34) |
| InChI Key | ZBKDZFAGSBEZLG-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C31H36N2O6 |
| Molecular Weight | 532.60 g/mol |
| Exact Mass | 532.25733687 g/mol |
| Topological Polar Surface Area (TPSA) | 86.30 Ų |
| XlogP | 4.80 |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 98.71% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.32% | 96.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 96.38% | 94.45% |
| CHEMBL220 | P22303 | Acetylcholinesterase | 95.71% | 94.45% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 94.24% | 96.77% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 93.16% | 90.71% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 90.32% | 90.00% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 89.14% | 90.24% |
| CHEMBL5028 | O14672 | ADAM10 | 88.35% | 97.50% |
| CHEMBL2107 | P61073 | C-X-C chemokine receptor type 4 | 88.17% | 93.10% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 88.00% | 85.14% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 87.90% | 89.63% |
| CHEMBL1744525 | P43490 | Nicotinamide phosphoribosyltransferase | 87.41% | 96.25% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 86.80% | 91.11% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 86.64% | 98.75% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 86.06% | 97.09% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 85.77% | 98.33% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 84.92% | 92.62% |
| CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 84.52% | 89.50% |
| CHEMBL6007 | O75762 | Transient receptor potential cation channel subfamily A member 1 | 84.06% | 92.17% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.77% | 89.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 83.37% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.75% | 95.89% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 82.46% | 94.73% |
| CHEMBL3691 | Q13822 | Autotaxin | 82.32% | 96.39% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 81.76% | 100.00% |
| CHEMBL4073 | P09237 | Matrix metalloproteinase 7 | 81.29% | 97.56% |
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.
| There are no matching plants. |
| PubChem | 75987720 |
| LOTUS | LTS0063944 |
| wikiData | Q105370678 |