Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | CHUK | O15111 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL18384602 | 0.91 | MAOA (0.38) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384538 | 0.91 | MAOA (0.38) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384583 | 0.85 | MAOA (0.38) | MAOACHUKACHE | |
| SCHEMBL18384566 | 0.85 | MAOA (0.38) | MAOACHUKACHE | |
| SCHEMBL18384547 | 0.85 | ACHE (0.35) | MAOAACHE | |
| SCHEMBL18384544 | 0.80 | MAOA (0.38) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384590 | 0.79 | MAOA (0.41) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384610 | 0.78 | MAOA (0.38) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384542 | 0.78 | MAOA (0.38) | MAOACHUKKDM4EALDH1A1GLA | |
| SCHEMBL18384573 | 0.78 | GSK3B (0.37) | MAOAKDM4EALDH1A1HTTHSD17B10 |
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-3127907-A1 | NEW TRICYCLIC QUINONE DERIVATIVE | Boston Biomedical, Inc. (US) | 2017-02-08 | — | — | EP | disclosed |