Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.31 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL8896867 | 0.87 | ALOX5 (0.58) | ALOX5MAOBCA12CA1CA2 | |
| SCHEMBL8896175 | 0.77 | ALOX5 (0.40) | ALOX5CHRNA7CYP1A2 | |
| SCHEMBL8060779 | 0.77 | ALOX5 (0.59) | ALOX5MAOBCA12CA1CA2 | |
| SCHEMBL8896191 | 0.74 | ALOX5 (0.53) | ALOX5MAOBTAS1R3TAS1R1KDM4E | |
| SCHEMBL10480284 | 0.74 | ALOX5 (0.71) | ALOX5 | |
| SCHEMBL8896909 | 0.73 | ALOX5 (0.54) | ALOX5MAOBTAS1R3TAS1R1KDM4E | |
| SCHEMBL8500496 | 0.71 | MAOA (0.42) | ALOX5MAOAMAOBCA12CA1 | |
| SCHEMBL8069842 | 0.70 | NPC1 (0.36) | MAPTKDM4EALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL6332567 | 0.70 | ALOX5 (0.54) | ALOX5MAOAMAOBCA12CA1 | |
| SCHEMBL8896748 | 0.68 | MAOB (0.37) | MAOBTAS1R3TAS1R1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0587110-B1 | Condensed heterocyclic derivatives and agricultural or horticultural fungicides containing the same | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1997-12-17 | — | — | EP | claimed |
| EP-0587110-B1 | Condensed heterocyclic derivatives and agricultural or horticultural fungicides containing the same | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1997-12-17 | — | — | EP | disclosed |