Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 18/20 | 0.53 |
| ▸ | ITGB1 | P05556 | 18/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGAV | P06756 | 1/20 | 0.48 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.48 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6509916 | 0.91 | ITGB1 (0.42) | ITGA4ITGB1ITGB3ITGAVITGA5 | |
| SCHEMBL7099259 | 0.78 | KLK5 (0.46) | ITGA4ITGB1ITGB3ITGB7ACE | |
| SCHEMBL5265844 | 0.77 | ITGA4 (0.49) | ITGA4ITGB1ITGB3ITGAVITGA5 | |
| SCHEMBL5262214 | 0.77 | ITGA4 (0.49) | ITGA4ITGB1ITGB3ITGAVITGA5 | |
| SCHEMBL7306740 | 0.76 | FPR2 (0.59) | MMEACEACE2 | |
| SCHEMBL30000376 | 0.76 | FPR2 (0.59) | MMEACEACE2 | |
| SCHEMBL7306758 | 0.76 | FPR2 (0.59) | MMEACEACE2 | |
| SCHEMBL30000049 | 0.76 | ACE (0.58) | MMEACEACE2 | |
| SCHEMBL7152922 | 0.75 | ITGB1 (0.73) | ITGA4ITGB1 | |
| SCHEMBL7152927 | 0.75 | ITGB1 (0.73) | ITGA4ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6911451-B1 | Phenylalanine derivatives | CELLTECH R&D LIMITED (GB) | 2005-06-28 | — | — | US | disclosed |