Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | PPOX | P50336 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | DHODH | Q02127 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6727520 | 0.82 | GPR139 (0.38) | DHODH | |
| SCHEMBL6730676 | 0.80 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2DHODHKDM4ETP53 | |
| SCHEMBL6735480 | 0.78 | MAPT (0.42) | CYP1A2CYP2C19CYP2C9PPOXALDH1A1 | |
| SCHEMBL6732677 | 0.78 | P2RX3 (0.40) | CYP1A2CYP2C19CYP2C9ALDH1A1MAPT | |
| SCHEMBL6732678 | 0.78 | P2RX3 (0.40) | CYP1A2CYP2C19CYP2C9ALDH1A1MAPT | |
| SCHEMBL6727419 | 0.75 | GPR139 (0.36) | CYP1A2CYP2C19CYP2C9GAAALDH1A1 | |
| SCHEMBL6724655 | 0.75 | SLC5A2 (0.36) | GAAALDH1A1DHODH | |
| SCHEMBL6727367 | 0.74 | PPOX (0.43) | PPOXALDH1A1HPGDLMNAMAPT | |
| SCHEMBL25425312 | 0.72 | PPOX (0.41) | CYP1A2CYP2C19PPOXGAAALDH1A1 | |
| SCHEMBL6730952 | 0.71 | PPOX (0.37) | PPOXDHODH |
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-1333031-A1 | BICYCLIC TRIAZOLONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME | Sumitomo Chemical Takeda Agro Company, Limited (JP) | 2003-08-06 | — | — | EP | disclosed |