Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 17/20 | 0.87 |
| ▸ | ITGAV | P06756 | 4/20 | 0.87 |
| ▸ | ITGA4 | P13612 | 11/20 | 0.61 |
| ▸ | ITGB7 | P26010 | 5/20 | 0.61 |
| ▸ | ITGA5 | P08648 | 5/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.50 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.48 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.48 |
| ▸ | ITGAL | P20701 | 2/20 | 0.48 |
| ▸ | ITGA2 | P17301 | 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 | |
|---|---|---|---|---|
| SCHEMBL3314255 | 1.00 | ITGB1 (0.87) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3315902 | 0.97 | ITGB1 (0.85) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3315359 | 0.96 | ITGB1 (0.80) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL6139776 | 0.94 | ITGB1 (0.77) | ITGB1ITGAVITGA4ITGB7ITGA2 | |
| SCHEMBL3313255 | 0.94 | ITGB1 (0.77) | ITGB1ITGAVITGA4ITGB7ITGA2 | |
| SCHEMBL3316690 | 0.93 | ITGB1 (0.85) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3313373 | 0.93 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL8352229 | 0.93 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3316398 | 0.93 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3313356 | 0.93 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 |
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-1501801-A1 | 2,6-QUINOLINYL AND 2,6-NAPHTHYL DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES AS VLA-4 INHIBITORS | UCB, S.A. (BE) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003093237-A1 | 2,6-QUINOLINYL AND 2,6-NAPHTHYL DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES AS VLA-4 INHIBITORS | UCB, S.A. (BE) | 2003-11-13 | — | — | WO | disclosed |