Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 19/20 | 0.57 |
| ▸ | ITGA4 | P13612 | 19/20 | 0.57 |
| ▸ | ITGB7 | P26010 | 18/20 | 0.57 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.51 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5009922 | 0.91 | ITGB1 (0.69) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL7417736 | 0.88 | ITGB1 (0.54) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL7415773 | 0.84 | ITGB1 (0.52) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL6238999 | 0.83 | ITGA4 (0.83) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL27542813 | 0.82 | ITGB1 (0.60) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL6639882 | 0.82 | ITGB1 (0.60) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL7432342 | 0.81 | L3MBTL1 (0.64) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL5162556 | 0.79 | ITGB1 (0.84) | ITGB1ITGA4ITGB7ITGA2 | |
| SCHEMBL5787065 | 0.79 | ITGA4 (0.56) | ITGB1ITGA4ITGB7 | |
| SCHEMBL6238214 | 0.79 | ITGA4 (0.82) | 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 |