Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.48 |
| ▸ | ABL1 | P00519 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2445205 | 0.96 | FFAR4 (0.47) | FFAR4TRPA1ABL1RAB9ANPC1 | |
| SCHEMBL481106 | 0.93 | TRPA1 (0.45) | FFAR4TRPA1RAB9ANPC1MEN1 | |
| SCHEMBL2447447 | 0.93 | ABL1 (0.47) | FFAR4TRPA1ABL1RAB9ANPC1 | |
| SCHEMBL480890 | 0.89 | ABL1 (0.46) | TRPA1ABL1RAB9ANPC1MEN1 | |
| SCHEMBL480419 | 0.89 | FFAR4 (0.48) | FFAR4TRPA1RAB9ANPC1MEN1 | |
| SCHEMBL4408309 | 0.89 | ABL1 (0.45) | TRPA1ABL1RAB9ANPC1KMT2A | |
| SCHEMBL15580544 | 0.86 | TRPA1 (0.50) | TRPA1ABL1RAB9AMEN1KMT2A | |
| SCHEMBL2440259 | 0.85 | TRPA1 (0.49) | TRPA1ABL1RAB9AMEN1KMT2A | |
| SCHEMBL480355 | 0.85 | TRPA1 (0.60) | TRPA1ABL1RAB9AMEN1KMT2A | |
| SCHEMBL480700 | 0.84 | TRPA1 (0.55) | TRPA1ABL1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011114184-A1 | AMIDES OF HETEROCYCLIC COMPOUNDS AS TRPA1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-09-22 | — | — | WO | disclosed |
| WO-2011114184-A1 | AMIDES OF HETEROCYCLIC COMPOUNDS AS TRPA1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-09-22 | — | — | WO | disclosed |