Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 20/20 | 0.84 |
| ▸ | ITGB7 | P26010 | 20/20 | 0.84 |
| ▸ | ITGB1 | P05556 | 19/20 | 0.84 |
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 | |
|---|---|---|---|---|
| SCHEMBL18068313 | 0.94 | ITGA4 (0.82) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5162637 | 0.94 | ITGA4 (0.82) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5162788 | 0.91 | ITGA4 (1.00) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5162530 | 0.89 | ITGA4 (0.81) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5159929 | 0.87 | ITGB1 (0.82) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5162535 | 0.85 | ITGA4 (0.89) | ITGA4ITGB7ITGB1 | |
| SCHEMBL5164089 | 0.85 | ITGB1 (1.00) | ITGA4ITGB7ITGB1 | |
| SCHEMBL18067795 | 0.85 | ITGB1 (0.85) | ITGA4ITGB7ITGB1 | |
| SCHEMBL18068322 | 0.85 | ITGB1 (1.00) | ITGA4ITGB7ITGB1 | |
| SCHEMBL7389435 | 0.84 | ITGB1 (0.76) | ITGA4ITGB7ITGB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1237878-B1 | 4-PYRIMIDINYL-N-ACYL-L-PHENYLALANINES | HOFFMANN LA ROCHE (CH) | 2007-03-21 | — | — | EP | disclosed |
| EP-1237878-A2 | 4-PYRIMIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-09-11 | — | — | EP | disclosed |
| US-6380387-B1 | ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS | HOFFMANN-LA ROCHE INC. | 2002-04-30 | — | — | US | disclosed |
| WO-2001042225-A2 | 4-PYRIMIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-06-14 | — | — | WO | disclosed |