Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 12/20 | 0.47 |
| ▸ | ITGA4 | P13612 | 12/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.40 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 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 | |
|---|---|---|---|---|
| SCHEMBL5850857 | 0.83 | ITGB1 (0.64) | ITGB1ITGA4ALDH1A1ITGB7TDP1 | |
| SCHEMBL7401948 | 0.81 | ITGB1 (0.61) | ITGB1ITGA4ALDH1A1ITGB7TDP1 | |
| SCHEMBL5850609 | 0.81 | MMP9 (0.49) | ITGB1ITGA4ALDH1A1ITGB7TDP1 | |
| SCHEMBL5852274 | 0.79 | ITGB1 (0.51) | ITGB1ITGA4ITGB7MMP9 | |
| SCHEMBL5850463 | 0.79 | PTPN2 (0.46) | ALDH1A1LMNA | |
| SCHEMBL5850545 | 0.77 | ITGB1 (0.52) | ITGB1ITGA4ITGB7TDP1 | |
| SCHEMBL5691025 | 0.77 | ITGB1 (0.63) | ITGB1ITGA4ALDH1A1ITGB7 | |
| SCHEMBL5850607 | 0.76 | ITGA4 (0.47) | ITGB1ITGA4ALDH1A1ITGB7TDP1 | |
| SCHEMBL5850632 | 0.76 | ALDH1A1 (0.41) | ITGB1ITGA4ALDH1A1LMNAHTT | |
| SCHEMBL5851039 | 0.76 | ATM (0.55) | ITGB1ITGA4ALDH1A1ITGB7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7030114-B1 | Compounds which inhibit leukocyte adhesion mediated by VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 2006-04-18 | — | — | US | disclosed |
| EP-0994895-A1 | DIPEPTIDE COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | Elan Pharmaceuticals, Inc. (US) | 2000-04-26 | — | — | EP | disclosed |
| WO-1999006435-A1 | DIPEPTIDE COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARMACEUTICALS, INC. (US) | 1999-02-11 | — | — | WO | disclosed |