Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL12715042 | 1.00 | TRPA1 (0.52) | TRPA1NPC1RAB9ATAAR1AOC3 | |
| SCHEMBL13924945 | 1.00 | TRPA1 (0.52) | TRPA1NPC1RAB9ATAAR1AOC3 | |
| SCHEMBL14204960 | 0.89 | TRPA1 (0.49) | TRPA1TAAR1AOC3APAF1CYP2D6 | |
| SCHEMBL12142365 | 0.88 | TRPA1 (0.47) | TRPA1TAAR1APAF1CYP2D6SRC | |
| SCHEMBL1716524 | 0.87 | TRPA1 (0.53) | TRPA1TAAR1AOC3APAF1CYP2D6 | |
| SCHEMBL16727663 | 0.86 | GRIA4 (0.49) | MAPK1 | |
| SCHEMBL12311411 | 0.85 | KMT2A (0.50) | TRPA1NPC1RAB9ATAAR1AOC3 | |
| SCHEMBL13921533 | 0.85 | MMP1 (0.51) | TRPA1TAAR1APAF1LMNA | |
| SCHEMBL13948388 | 0.85 | MMP1 (0.51) | TRPA1TAAR1APAF1LMNA | |
| SCHEMBL13904059 | 0.85 | TRPA1 (0.45) | TRPA1NPC1RAB9ATAAR1APAF1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20090036638-A1 | Contrast Dyes for Inkjet Lithographic Printing Plates | AGFA GRAPHICS NV (BE) | 2009-02-05 | — | — | US | disclosed |
| WO-2007071550-A1 | INKJET INK FOR PREPARING LITHOGRAPHIC PRINTING PLATES AND METHOD FOR THEIR PREPARATION | AGFA GRAPHICS NV (BE) | 2007-06-28 | — | — | WO | disclosed |