Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 7/20 | 0.68 |
| ▸ | HPSE | Q9Y251 | 2/20 | 0.65 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.62 |
| ▸ | PDE5A | O76074 | 1/20 | 0.60 |
| ▸ | METAP1 | P53582 | 2/20 | 0.57 |
| ▸ | METAP2 | P50579 | 1/20 | 0.57 |
| ▸ | MGAM | O43451 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | SI | P14410 | 1/20 | 0.56 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL1284270 | 0.84 | AURKA (0.73) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL6265481 | 0.83 | AURKA (0.68) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL28223244 | 0.83 | AURKA (0.68) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL28693174 | 0.83 | AURKA (0.68) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL11770396 | 0.83 | AURKA (0.70) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL11155883 | 0.83 | AURKA (0.67) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| Hydrochloric Acid SCHEMBL11776694 | 0.83 | AURKA (0.71) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL7393911 | 0.83 | AURKA (0.66) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| Hydrochloric Acid SCHEMBL11772488 | 0.82 | AURKA (0.66) | AURKAHPSEPRMT5PDE5AMETAP1 | |
| SCHEMBL1170747 | 0.82 | METAP1 (0.72) | AURKAHPSEPRMT5PDE5AMETAP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001066526-A1 | ESTER DERIVATIVES OF DIMETHYLPROPIONIC ACID AND PHARMACETUICAL COMPOSITIONS CONTAINING THEM | CERMOL S.A. (CH) | 2001-09-13 | — | — | WO | disclosed |
| EP-1132381-A1 | Ester derivatives of dimethylpropionic acid and pharmaceutical compositions containing them | CERMOL S.A. (CH) | 2001-09-12 | — | — | EP | disclosed |
| US-3985891-A | CARDIOTONICS, ANTICOAGULANTS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-10-12 | — | — | US | disclosed |