Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8845506 | 0.78 | CA1 (0.48) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL4089154 | 0.78 | CA1 (0.48) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL4093682 | 0.77 | CA1 (0.46) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL18043699 | 0.75 | CA1 (0.55) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL31644414 | 0.74 | MAOB (0.50) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL12198271 | 0.72 | MAOB (0.53) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL19730846 | 0.72 | LTA4H (0.50) | SLC6A4SLC6A3TDP1GAAMAPT | |
| SCHEMBL18722105 | 0.72 | MAOB (0.45) | MAOBMAOACA1CA2CA7 | |
| SCHEMBL19731521 | 0.72 | MEN1 (0.35) | SLC6A4GAAMAPTNPC1RAB9A | |
| SCHEMBL8845470 | 0.71 | ESR2 (0.52) | MAOBMAOACA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017216576-A1 | AUTOPHAGY INDUCER COMPOUNDS | EPSILON-3 BIO LIMITED (GB) | 2017-12-21 | — | — | WO | disclosed |