Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 20/20 | 0.55 |
| ▸ | ITGA4 | P13612 | 20/20 | 0.55 |
| ▸ | ITGB7 | P26010 | 15/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL3315772 | 0.91 | TACR1 (0.52) | ITGB1ITGA4ITGB7 | |
| SCHEMBL3314549 | 0.86 | ITGB1 (0.61) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4627756 | 0.84 | ITGB1 (0.54) | ITGB1ITGA4ITGB7 | |
| SCHEMBL3318550 | 0.84 | TPH1 (0.50) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL3313204 | 0.83 | TPH1 (0.51) | ITGB1ITGA4 | |
| SCHEMBL13398463 | 0.82 | ITGB1 (0.50) | ITGB1ITGA4ITGB7 | |
| SCHEMBL13398420 | 0.81 | ALDH1A1 (0.52) | ITGB1ITGA4ITGB7 | |
| SCHEMBL8712438 | 0.79 | MME (0.65) | — | |
| SCHEMBL607215 | 0.79 | MME (0.65) | — | |
| SCHEMBL607214 | 0.79 | MME (0.65) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501801-B1 | 2,6-QUINOLINYL AND 2,6-NAPHTHYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF VLA-4 DEPENDENT DISEASES | UCB PHARMA SA (BE) | 2008-01-23 | — | — | EP | claimed |