Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | TYR | P14679 | 2/20 | 0.38 |
| ▸ | SYNJ2 | O15056 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2046337 | 0.79 | CA3 (0.46) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL2046339 | 0.79 | CA3 (0.46) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL958847 | 0.76 | ALDH1A1 (0.58) | CA9CA14CYP1A2ARTYR | |
| SCHEMBL958846 | 0.76 | ALDH1A1 (0.58) | CA9CA14CYP1A2ARTYR | |
| SCHEMBL876257 | 0.74 | NFE2L2 (0.39) | ARNFE2L2 | |
| SCHEMBL15093161 | 0.74 | NFE2L2 (0.39) | ARNFE2L2 | |
| SCHEMBL30536217 | 0.74 | NFE2L2 (0.53) | CYP1A1CYP1B1CYP1A2PTGS1AR | |
| SCHEMBL27796096 | 0.74 | CA3 (0.50) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL29728702 | 0.73 | LMNA (0.58) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL1404850 | 0.73 | LMNA (0.58) | CA3CA6CA5ACA9CA14 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2194046-B1 | Triazolone derivative | EISAI R&D MAN CO LTD (JP) | 2012-05-09 | — | — | EP | disclosed |