Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3177319 | 0.98 | KDM4E (0.32) | TRPA1CYP1A2CYP2D6 | |
| SCHEMBL452614 | 0.76 | — | — | |
| SCHEMBL11767356 | 0.69 | TRPA1 (0.52) | TRPA1CYP1A2CYP2D6ALOX5 | |
| SCHEMBL34463644 | 0.68 | — | — | |
| SCHEMBL6808163 | 0.67 | — | — | |
| SCHEMBL1938763 | 0.64 | TRPA1 (0.42) | TRPA1CYP1A2CYP2D6ALOX5 | |
| SCHEMBL207166 | 0.62 | TRPA1 (0.32) | TRPA1CYP1A2CYP2D6 | |
| SCHEMBL9844067 | 0.59 | LMNA (0.41) | TRPA1CYP1A2CYP2D6 | |
| SCHEMBL5034772 | 0.59 | TRPA1 (0.42) | TRPA1ALOX5 | |
| SCHEMBL2094585 | 0.59 | TRPA1 (0.42) | TRPA1ALOX5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0219852-B1 | CHARTREUSIN DERIVATIVES, SALTS THEREOF, ANTITUMOROUS COMPOSITIONS CONTAINING THE SAME, AND PROCESSES FOR PRODUCING THE SAME | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1992-02-05 | — | — | EP | disclosed |
| US-5064945-A | Antitumor Agents | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1991-11-12 | — | — | US | disclosed |
| US-4927919-A | ANTITUMOR AGENTS | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1990-05-22 | — | — | US | disclosed |
| EP-0219852-A2 | Chartreusin derivatives, salts thereof, antitumorous compositions containing the same, and processes for producing the same | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1987-04-29 | — | — | EP | disclosed |