Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Adonitol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.54 |
| ▸ | OR51E2 | Q9H255 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Mannitol SCHEMBL31441251 | 0.94 | LMNA (0.69) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Mannitol SCHEMBL19951541 | 0.94 | LMNA (0.69) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Galactitol SCHEMBL31441250 | 0.94 | LMNA (0.69) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Adonitol SCHEMBL29012527 | 0.90 | LMNA (0.62) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| E968 SCHEMBL28441780 | 0.87 | PDE4A (0.50) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Adonitol SCHEMBL27714236 | 0.85 | PDE4A (0.56) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Adonitol SCHEMBL20481329 | 0.85 | PDE4A (0.56) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Adonitol SCHEMBL20481340 | 0.85 | PDE4A (0.56) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Sorbitol SCHEMBL31013480 | 0.84 | LMNA (0.73) | PDE4ALMNAL3MBTL1TDP1USP2 | |
| Mannitol SCHEMBL30410531 | 0.84 | LMNA (0.73) | PDE4ALMNAL3MBTL1TDP1USP2 |
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-106631779-B | Polyol esters and their use in processing halogenated vinyl polymers | 济南金昌树新材料科技有限公司 | 2020-07-14 | — | — | CN | disclosed |