Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.39 |
| ▸ | CFD | P00746 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 4/20 | 0.38 |
| ▸ | F2 | P00734 | 3/20 | 0.38 |
| ▸ | F10 | P00742 | 3/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.38 |
| ▸ | F7 | P08709 | 3/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.38 |
| ▸ | METAP2 | P50579 | 9/20 | 0.36 |
| ▸ | F9 | P00740 | 1/20 | 0.36 |
| ▸ | F12 | P00748 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16635641 | 0.89 | TRPA1 (0.46) | TRPA1CFDALDH1A1 | |
| SCHEMBL17959575 | 0.86 | HDAC8 (0.39) | TRPA1CFDF11F2F10 | |
| SCHEMBL16647936 | 0.86 | HDAC8 (0.39) | TRPA1CFDF11F2F10 | |
| SCHEMBL16634840 | 0.77 | ALDH1A1 (0.39) | TRPA1METAP2ALDH1A1P2RX7 | |
| SCHEMBL16635467 | 0.77 | TRPA1 (0.46) | TRPA1CFD | |
| SCHEMBL17959577 | 0.76 | TRPA1 (0.44) | TRPA1CFDALDH1A1 | |
| SCHEMBL16647938 | 0.76 | TRPA1 (0.44) | TRPA1CFDALDH1A1 | |
| SCHEMBL16396351 | 0.72 | AKR1B1 (0.40) | METAP2ALDH1A1 | |
| SCHEMBL16634985 | 0.71 | TRPA1 (0.71) | TRPA1 | |
| SCHEMBL16635044 | 0.71 | TRPA1 (0.71) | TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3055302-A1 | SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS | F. Hoffmann-La Roche AG (CH) | 2016-08-17 | — | — | EP | disclosed |
| WO-2015052264-A1 | SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-16 | — | — | WO | disclosed |