Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 10/20 | 0.61 |
| ▸ | ITGB1 | P05556 | 9/20 | 0.61 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.56 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.56 |
| ▸ | ITGAL | P20701 | 2/20 | 0.56 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ITGB7 | P26010 | 7/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | IL2 | P60568 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7414372 | 0.93 | ITGB1 (0.52) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL7415187 | 0.88 | ITGB1 (0.61) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL7416080 | 0.81 | ITGB1 (0.52) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL4649073 | 0.78 | ITGA4 (0.59) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL4649064 | 0.78 | ITGA4 (0.59) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL4893859 | 0.75 | ITGA4 (0.78) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL4892883 | 0.75 | ITGA4 (1.00) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL5162599 | 0.75 | ITGA4 (0.74) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL5133478 | 0.73 | ITGA4 (0.79) | ITGA4ITGB1ITGB2ICAM1ITGAL | |
| SCHEMBL4648129 | 0.72 | ITGA4 (0.53) | ITGA4ITGB1ITGB2ICAM1ITGAL |
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-1244625-A1 | 4-PYRIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-02 | — | — | EP | claimed |
| WO-2001042215-A1 | 4-PYRIDINYL-N-ACYL-L-PHENYLALANINES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-06-14 | — | — | WO | claimed |
| 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 |