Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | F2R | P25116 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29280610 | 0.86 | CES2 (0.44) | CES2CES1F2RPKMALDH1A1 | |
| SCHEMBL852652 | 0.82 | SLC6A4 (0.47) | CES2CES1F2RPKMMAPT | |
| SCHEMBL3184249 | 0.82 | CES2 (0.68) | CES2CES1MAPTALDH1A1KDM4E | |
| SCHEMBL29280622 | 0.81 | NPC1 (0.49) | CES2CES1MAPTALDH1A1KDM4E | |
| SCHEMBL3779540 | 0.81 | CES2 (0.46) | CES2CES1MAPTKDM4ENPC1 | |
| SCHEMBL3312856 | 0.80 | MAPT (0.40) | CES2CES1F2RPKMMAPT | |
| SCHEMBL3312859 | 0.80 | MAPT (0.40) | CES2CES1F2RPKMMAPT | |
| SCHEMBL29280636 | 0.78 | CES2 (0.50) | CES2CES1F2RPKMMAPT | |
| SCHEMBL31582781 | 0.77 | F2R (0.44) | CES2CES1F2RPKMMAPT | |
| SCHEMBL22916677 | 0.77 | MAPT (0.41) | MAPTALDH1A1NPSR1L3MBTL1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117777172-A | Benzo five-membered ring boric acid ester-3-carboxylic acid compound and application thereof | 四川大学 | 2024-03-29 | — | — | CN | disclosed |