Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 5/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Allylbenzene SCHEMBL876405 | 0.83 | MAOB (0.48) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL28159807 | 0.81 | PTGS2 (0.46) | TRPA1PTGS2SMN1; SMN2CYP3A4TP53 | |
| Allylbenzene SCHEMBL11127861 | 0.79 | MAOB (0.52) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL27581309 | 0.79 | MAOB (0.52) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL15282877 | 0.79 | MAOB (0.57) | TRPA1SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL5593566 | 0.79 | MAOB (0.57) | TRPA1SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL318129 | 0.79 | MAOB (0.57) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL27636637 | 0.79 | MAOB (0.57) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL821993 | 0.77 | SLC6A2 (0.50) | PTGS2SMN1; SMN2CYP3A4TP53TSHR | |
| Allylbenzene SCHEMBL29084614 | 0.77 | MAOB (0.46) | PTGS2SMN1; SMN2CYP3A4TP53TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2167237-A | — | — | None | — | — | JP | disclosed |
| JP-H02167237-A | PRODUCTION OF 1-(ALKYL OR ALKENYL)-6'-METHYLNAPHTHALENE | MITSUBISHI GAS CHEM CO INC | 1990-06-27 | — | — | JP | disclosed |