Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 18/20 | 0.50 |
| ▸ | ITGAV | P06756 | 1/20 | 0.50 |
| ▸ | ITGA4 | P13612 | 17/20 | 0.37 |
| ▸ | ITGB7 | P26010 | 6/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6141406 | 1.00 | ITGB1 (0.50) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL3312652 | 0.84 | ITGB1 (0.65) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312661 | 0.84 | ITGB1 (0.65) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL4625549 | 0.80 | ITGB1 (0.54) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL6142370 | 0.78 | ITGB1 (0.66) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL6141473 | 0.77 | ITGB1 (0.55) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL3312918 | 0.77 | ITGB1 (0.62) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL3312924 | 0.77 | ITGB1 (0.62) | ITGB1ITGAVITGA4ITGB7 | |
| SCHEMBL6141061 | 0.76 | ITGB1 (0.55) | ITGB1ITGAVITGA4ITGB7ABL1 | |
| SCHEMBL6141563 | 0.76 | ITGB1 (0.46) | 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 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 |