Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 12/20 | 0.76 |
| ▸ | ITGAV | P06756 | 4/20 | 0.76 |
| ▸ | ITGA4 | P13612 | 7/20 | 0.48 |
| ▸ | ITGB7 | P26010 | 4/20 | 0.48 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | ITGA5 | P08648 | 4/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.39 |
| ▸ | MME | P08473 | 2/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL13398404 | 0.89 | ITGB1 (0.64) | ITGB1ITGAVITGA4ITGB7SCN3A | |
| SCHEMBL4626491 | 0.87 | ITGB1 (0.73) | ITGB1ITGAVITGA4ITGB7SCN3A | |
| SCHEMBL3313373 | 0.86 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3313356 | 0.86 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL3316398 | 0.86 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL8352229 | 0.86 | ITGB1 (1.00) | ITGB1ITGAVITGA4ITGB7ITGA5 | |
| SCHEMBL4419511 | 0.85 | ITGB1 (0.83) | ITGB1ITGAVITGA4ITGB7SCN3A | |
| SCHEMBL4625481 | 0.85 | ITGB1 (0.54) | ITGB1ITGAVPIN1MMEACE | |
| SCHEMBL3318272 | 0.85 | ITGB1 (0.85) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL4625629 | 0.84 | ITGAV (0.69) | 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 | disclosed |