Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PLA2G4B | P0C869 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14237206 | 0.85 | TSHR (0.46) | CES2CES1LMNAPLA2G4BTSHR | |
| SCHEMBL4591841 | 0.84 | CES1 (0.47) | CES2CES1LMNANAAAGAA | |
| SCHEMBL169021 | 0.84 | CES1 (0.44) | CES2CES1LMNANAAATDP1 | |
| SCHEMBL8083975 | 0.83 | CES1 (0.47) | CES2CES1TSHRNAAAGAA | |
| SCHEMBL10384825 | 0.80 | LMNA (0.46) | CES2CES1LMNATSHRTP53 | |
| SCHEMBL4629163 | 0.80 | LMNA (0.46) | CES2CES1LMNATSHRTP53 | |
| SCHEMBL15651 | 0.80 | CES1 (0.49) | CES2CES1LMNATSHRNAAA | |
| SCHEMBL3675573 | 0.79 | CES1 (0.44) | CES2CES1NAAAGAA | |
| SCHEMBL7589437 | 0.79 | CES2 (0.46) | CES2CES1LMNAPLA2G4BTSHR | |
| SCHEMBL4591845 | 0.78 | TSHR (0.46) | CES2CES1LMNAPLA2G4BTSHR |
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-101500534-A | Compositions comprising betulonic acid | VALTION TEKNILLINEN (FI) | 2009-08-05 | — | — | CN | disclosed |