Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 3/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | YWHAG | P61981 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11913916 | 0.84 | TUBB4A (0.48) | ALOX5PTPN1NPC1ALDH1A1RAB9A | |
| SCHEMBL11913915 | 0.84 | NR3C1 (0.55) | QDPRALOX5PTPN1ALDH1A1MEN1 | |
| SCHEMBL11913917 | 0.81 | GAA (0.46) | ALOX5PTPN1NPC1ALDH1A1RAB9A | |
| SCHEMBL14323026 | 0.81 | GAA (0.46) | ALOX5PTPN1NPC1ALDH1A1RAB9A | |
| SCHEMBL17320655 | 0.79 | ALOX5 (0.55) | QDPRALOX5PTPN1YWHAGALDH1A1 | |
| SCHEMBL11913918 | 0.75 | PTAFR (0.51) | ALDH1A1 | |
| SCHEMBL11913919 | 0.75 | MAPK9 (0.54) | ALDH1A1SMN1; SMN2POLBCYP3A4CYP2D6 | |
| SCHEMBL14413593 | 0.74 | ALDH1A1 (0.49) | NPC1ALDH1A1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL751413 | 0.74 | ALDH1A1 (0.49) | NPC1ALDH1A1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL11892291 | 0.74 | ALDH1A1 (0.49) | NPC1ALDH1A1RAB9ASMN1; SMN2MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007004740-A1 | VANILLIN ACETALS AND SENSORY STIMULANT COMPOSITION CONTAINING THE SAME | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2007-01-11 | — | — | WO | disclosed |