Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGAV | P06756 | 1/20 | 0.43 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 3/20 | 0.40 |
| ▸ | CTSK | P43235 | 3/20 | 0.40 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | LY96 | Q9Y6Y9 | 1/20 | 0.39 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326273 | 0.90 | ITGB3 (0.41) | ITGB3ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL7102789 | 0.85 | KLK5 (0.52) | ALDH1A1GAAGFERLCKCTSS | |
| SCHEMBL20529400 | 0.85 | KLK5 (0.52) | ALDH1A1GAAGFERLCKCTSS | |
| SCHEMBL3816383 | 0.83 | CYP1A2 (0.48) | ALDH1A1GAAGFERCTSSCTSK | |
| SCHEMBL7160906 | 0.83 | CYP1A2 (0.48) | ALDH1A1GAAGFERCTSSCTSK | |
| SCHEMBL14143713 | 0.83 | ITGB3 (0.41) | ITGB3ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL29528955 | 0.81 | CTSS (0.48) | CTSSCTSKCTSBLNPEPACE | |
| SCHEMBL16972916 | 0.81 | ACE (0.57) | ITGB3ITGAVCTSSCTSKCTSB | |
| SCHEMBL16972918 | 0.81 | ACE (0.57) | ITGB3ITGAVCTSSCTSKCTSB | |
| SCHEMBL29529273 | 0.81 | CTSS (0.48) | ITGB3CTSSCTSKCTSBLNPEP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7371854-B2 | Method for the production of bicyclic aromatic amino acids and intermediate products thereof | MERCK PATENT GMBH (DE) | 2008-05-13 | — | — | US | disclosed |
| US-7371854-B2 | Method for the production of bicyclic aromatic amino acids and intermediate products thereof | MERCK PATENT GMBH (DE) | 2008-05-13 | — | — | US | disclosed |