Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 20/20 | 0.79 |
| ▸ | ITGA4 | P13612 | 20/20 | 0.79 |
| ▸ | ITGB7 | P26010 | 20/20 | 0.79 |
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 | |
|---|---|---|---|---|
| SCHEMBL5134886 | 0.97 | ITGB1 (0.78) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4893593 | 0.92 | ITGB1 (0.83) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4894706 | 0.90 | ITGB1 (0.74) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4892894 | 0.90 | ITGB1 (0.76) | ITGB1ITGA4ITGB7 | |
| SCHEMBL5010519 | 0.89 | ITGB1 (0.64) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4893544 | 0.89 | ITGB1 (0.83) | ITGB1ITGA4ITGB7 | |
| SCHEMBL7421582 | 0.89 | ITGB1 (0.79) | ITGB1ITGA4ITGB7 | |
| SCHEMBL6237580 | 0.88 | ITGB1 (1.00) | ITGB1ITGA4ITGB7 | |
| SCHEMBL6235835 | 0.88 | ITGB1 (0.84) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4884746 | 0.87 | ITGB1 (0.74) | ITGB1ITGA4ITGB7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1244625-A1 | 4-PYRIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001042215-A1 | 4-PYRIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-06-14 | — | — | WO | disclosed |