Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7298271 | 0.73 | NOTUM (0.37) | — | |
| SCHEMBL7288889 | 0.73 | ADRA2A (0.33) | — | |
| SCHEMBL7299199 | 0.73 | ADRA2A (0.33) | — | |
| SCHEMBL7300190 | 0.72 | TRPA1 (0.36) | TRPA1KDM4EALDH1A1MCL1TSHR | |
| SCHEMBL7128137 | 0.71 | ITGB2 (0.44) | TRPA1KDM4E | |
| SCHEMBL10439269 | 0.71 | KDM4E (0.36) | TRPA1KDM4EALDH1A1MCL1TSHR | |
| SCHEMBL3188143 | 0.69 | PARP1 (0.47) | TRPA1KDM4EALDH1A1TSHR | |
| SCHEMBL7312064 | 0.69 | TAAR1 (0.31) | — | |
| SCHEMBL7292477 | 0.69 | TSHR (0.32) | TRPA1KDM4EALDH1A1TSHR | |
| SCHEMBL7298111 | 0.67 | TDP1 (0.40) | ALDH1A1MCL1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5260444-A | Cardiovascular, hypotensive | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1993-11-09 | — | — | US | disclosed |
| US-5208245-A | Hypotensive agents | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1993-05-04 | — | — | US | disclosed |
| EP-0460418-A2 | Novel Dihydropyridine derivative | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1991-12-11 | — | — | EP | disclosed |