Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PLA2G4B | P0C869 | 6/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 4/20 | 0.35 |
| ▸ | CES1 | P23141 | 4/20 | 0.35 |
| ▸ | PLA2G6 | O60733 | 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 | |
|---|---|---|---|---|
| SCHEMBL22922026 | 0.91 | CES2 (0.41) | CES2GMNNTP53POLBMAPT | |
| SCHEMBL22921751 | 0.89 | EPHX2 (0.39) | CES2GMNNTP53POLBMAPT | |
| SCHEMBL20548069 | 0.89 | CES2 (0.52) | CES2THRBPLA2G4BEPHX2CYP2C19 | |
| SCHEMBL9007929 | 0.86 | TSHR (0.50) | HSD17B10PLA2G4BTSHR | |
| SCHEMBL25856021 | 0.85 | CES2 (0.48) | CES2MAPTTHRBPLA2G4BEPHX2 | |
| SCHEMBL25855954 | 0.85 | CES2 (0.47) | CES2THRBPLA2G4BEPHX2CYP2C19 | |
| SCHEMBL25996488 | 0.82 | ALDH1A1 (0.38) | CES2POLBMAPTTHRBPLA2G4B | |
| SCHEMBL25996487 | 0.80 | ALDH1A1 (0.39) | POLBMAPTTHRBPLA2G4BTSHR | |
| Ether SCHEMBL6243423 | 0.79 | CES2 (0.62) | CES2MAPTTHRBHSD17B10PLA2G4B | |
| Ether SCHEMBL6242095 | 0.79 | CES2 (0.62) | CES2MAPTTHRBHSD17B10PLA2G4B |
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 |
|---|---|---|---|---|---|---|---|
| EP-4003314-B1 | FUNCTIONALIZED LONG-CHAIN HYDROCARBON MONO- AND DI-CARBOXYLIC ACIDS USEFUL FOR THE PREVENTION OR TREATMENT OF DISEASE | ESPERVITA THERAPEUTICS INC (US) | 2024-07-10 | — | — | EP | disclosed |