Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.42 |
| ▸ | WNT3A | P56704 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9747177 | 0.83 | CTNNB1 (0.55) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL19287209 | 0.77 | CTNNB1 (0.53) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL29466796 | 0.75 | CES2 (1.00) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL29466797 | 0.75 | CES2 (1.00) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL211487 | 0.75 | CES2 (1.00) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL27621482 | 0.73 | CES2 (0.69) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL31249613 | 0.72 | CES2 (0.62) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL29976899 | 0.72 | CES2 (0.82) | CES2CES1LMNAL3MBTL1NAPRT | |
| SCHEMBL225566 | 0.72 | CES2 (0.55) | CES2CES1LMNAL3MBTL1NAPRT | |
| 2-Picolinic Acid SCHEMBL444767 | 0.70 | CES2 (0.64) | CES2CES1LMNAL3MBTL1NAPRT |
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-117500802-A | LACTIVICIN compounds, their preparation and their use as antibacterial agents | 费多拉制药有限公司 | 2024-02-02 | — | — | CN | disclosed |