Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | CES2 | O00748 | 1/20 | 0.59 |
| ▸ | CES1 | P23141 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | RGS12 | O14924 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29291319 | 0.89 | NPC1 (0.47) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL29291317 | 0.88 | LMNA (0.46) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL29291311 | 0.88 | CES2 (0.47) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL29291318 | 0.85 | CES2 (0.57) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL29291321 | 0.84 | MAPT (0.56) | LMNACES2CES1L3MBTL1ALDH1A1 | |
| SCHEMBL29291313 | 0.82 | CES1 (0.53) | LMNACES2CES1TDP1ALDH1A1 | |
| SCHEMBL3179224 | 0.79 | LMNA (0.63) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL26599148 | 0.79 | TDP1 (0.52) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL5595457 | 0.78 | LMNA (0.61) | LMNACES2CES1TDP1L3MBTL1 | |
| SCHEMBL4483081 | 0.77 | TDP1 (0.61) | LMNACES2CES1TDP1L3MBTL1 |
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-109734571-B | Method for synthesizing alpha-F-beta-OH-carbonyl compound | 浙江工业大学 | 2021-11-30 | — | — | CN | disclosed |