Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 14/20 | 0.55 |
| ▸ | ITGAV | P06756 | 1/20 | 0.55 |
| ▸ | ITGA4 | P13612 | 13/20 | 0.43 |
| ▸ | ITGB7 | P26010 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6140351 | 0.94 | ITGB1 (0.48) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL6140062 | 0.92 | ITGB1 (0.59) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL6139884 | 0.90 | ITGB1 (0.59) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL6142066 | 0.88 | ITGB1 (0.45) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL6140246 | 0.87 | ITGB1 (0.51) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL6141601 | 0.86 | ITGB1 (0.39) | ITGB1ITGAVITGA4ALDH1A1HSD17B10 | |
| SCHEMBL3320849 | 0.84 | ITGB1 (0.56) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL3317244 | 0.80 | ITGB1 (0.70) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL4410500 | 0.79 | ITGB1 (0.53) | ITGB1ITGAVITGA4ITGB7ALDH1A1 | |
| SCHEMBL3317863 | 0.79 | ITGB1 (0.53) | ITGB1ITGAVITGA4ITGB7ALDH1A1 |
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 |