Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | LIPE | Q05469 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | CDC25B | P30305 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| 2-Tridecanone SCHEMBL27673021 | 0.91 | PRKCA (0.35) | — | |
| Pulegone SCHEMBL3064832 | 0.88 | PTPN2 (0.35) | ALDH1A1NPC1HPGDRAB9AKDM4E | |
| Pulegone SCHEMBL9292430 | 0.86 | PTPN2 (0.38) | ALDH1A1NPC1HPGDRAB9AKDM4E | |
| Pulegone SCHEMBL8836768 | 0.86 | ALDH1A1 (0.34) | ALDH1A1NPC1HPGDRAB9AKDM4E | |
| Pulegone SCHEMBL27243547 | 0.86 | ALDH1A1 (0.34) | ALDH1A1NPC1HPGDRAB9AKDM4E | |
| Pulegone SCHEMBL6517913 | 0.75 | — | — | |
| Pulegone SCHEMBL17963980 | 0.72 | TLR4 (0.31) | NPC1L3MBTL1 | |
| SCHEMBL27902418 | 0.70 | TLR4 (0.33) | ALDH1A1NPC1HPGDRAB9AKDM4E | |
| SCHEMBL9292431 | 0.67 | PTPN2 (0.32) | PTPN1 | |
| SCHEMBL9075333 | 0.65 | CRBN (0.34) | ALDH1A1HPGDKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6121234-A | ORALLY COADMINISTERING TO MAMMAL PHARMACEUTICAL COMPOUND AND ESSENTIAL OIL | AVMAX, INC. (US) | 2000-09-19 | — | — | US | disclosed |
| US-5916566-A | Use of benzoin gum to inhibit P-glycoprotein-mediated resistance of pharmaceutical compounds | AVMAX, INC. (US) | 1999-06-29 | — | — | US | disclosed |
| US-5716928-A | ADMINISTERING DRUG CONCURRENTLY WITH ESSENTIAL OIL | AVMAX, INC. (US) | 1998-02-10 | — | — | US | disclosed |