Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 7/20 | 0.48 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LIPE | Q05469 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16827502 | 0.89 | AOC3 (0.49) | AOC3BCAT2RAB9AMAPTNPC1 | |
| SCHEMBL22871289 | 0.86 | CYP11B2 (0.53) | BCAT2MAPTALDH1A1SMN1; SMN2SRD5A1 | |
| SCHEMBL22871332 | 0.86 | BCAT2 (0.48) | AOC3BCAT2RAB9AKDM4EMAPT | |
| SCHEMBL16827328 | 0.85 | AOC3 (0.50) | AOC3BCAT2RAB9AMAPTNPC1 | |
| SCHEMBL16827326 | 0.85 | AOC3 (0.50) | AOC3BCAT2RAB9AMAPTNPC1 | |
| SCHEMBL16848202 | 0.84 | AOC3 (0.61) | AOC3CA1CA2RAB9AGAA | |
| SCHEMBL29438613 | 0.83 | PDE4A (0.55) | AOC3RAB9ANPC1PKM | |
| SCHEMBL29438611 | 0.83 | PDE4A (0.55) | AOC3RAB9ANPC1PKM | |
| SCHEMBL16827362 | 0.83 | PDE4A (0.55) | AOC3RAB9ANPC1PKM | |
| SCHEMBL12870758 | 0.82 | AOC3 (0.58) | AOC3RAB9AKDM4EGAAMAPT |
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-2012170371-A1 | COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | N30 PHARMACEUTICALS, LLC (US) | 2012-12-13 | — | — | WO | disclosed |