Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.54 |
| ▸ | GSR | P00390 | 1/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.49 |
| ▸ | GABRB1 | P18505 | 5/20 | 0.49 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.49 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.49 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.49 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.49 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9198461 | 0.85 | TRPA1 (0.54) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL4328080 | 0.85 | TRPA1 (0.61) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL11519193 | 0.84 | TRPA1 (0.52) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL4322717 | 0.81 | TRPA1 (0.50) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL27261832 | 0.81 | TRPA1 (0.50) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL25306122 | 0.81 | THRA (0.57) | ALDH1A1THRATHRBMAPT | |
| SCHEMBL9422308 | 0.80 | GAA (0.59) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL5929237 | 0.80 | TRPA1 (0.52) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL9556774 | 0.80 | TRPA1 (0.49) | TRPA1GSRGABRA1GABRB1GABRB2 | |
| SCHEMBL15239501 | 0.79 | GABRA1 (0.54) | TRPA1GSRGABRA1GABRB1GABRB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0316790-B1 | RHODANINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS AND THEIR USE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1993-08-11 | — | — | EP | disclosed |
| US-4897406-A | CHEMICAL MEDIATOR INHIBITORS INCLUDING LEUKOTRIENES; ANTIALLERGENS; BRONCHODILATOR AND ANTIICHEMIC AGENTS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1990-01-30 | — | — | US | disclosed |
| EP-0316790-A1 | Rhodanine derivatives, a process for their preparation, pharmaceutical compositions and their use | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1989-05-24 | — | — | EP | disclosed |