Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 19/20 | 0.54 |
| ▸ | ITGAV | P06756 | 1/20 | 0.54 |
| ▸ | ITGA4 | P13612 | 18/20 | 0.50 |
| ▸ | ITGB7 | P26010 | 6/20 | 0.50 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3312661 | 0.92 | ITGB1 (0.65) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312652 | 0.92 | ITGB1 (0.65) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312918 | 0.85 | ITGB1 (0.62) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312924 | 0.85 | ITGB1 (0.62) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312536 | 0.84 | ITGB1 (0.58) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL3317014 | 0.84 | ITGB1 (0.70) | ITGB1ITGA4ITGB7 | |
| SCHEMBL3317037 | 0.84 | ITGB1 (0.70) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4625209 | 0.84 | ITGB1 (0.70) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4625181 | 0.84 | ITGB1 (0.70) | ITGB1ITGA4ITGB7 | |
| SCHEMBL4624559 | 0.82 | ITGB1 (0.54) | ITGB1ITGAVITGA4ITGB7ABL1 |
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 |