Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 18/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 17/20 | 0.48 |
| ▸ | ITGB7 | P26010 | 7/20 | 0.45 |
| ▸ | FPR2 | P25090 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21540487 | 0.88 | ITGA4 (0.48) | ITGA4ITGB1ITGB7 | |
| SCHEMBL3835537 | 0.85 | FPR2 (0.49) | ITGA4ITGB1ITGB7FPR2 | |
| SCHEMBL21519758 | 0.83 | ITGA4 (0.60) | ITGA4ITGB1ITGB7 | |
| SCHEMBL4314341 | 0.83 | ITGA4 (0.60) | ITGA4ITGB1ITGB7 | |
| SCHEMBL4315119 | 0.83 | TPH1 (0.49) | — | |
| SCHEMBL21519755 | 0.83 | TPH1 (0.49) | — | |
| SCHEMBL19235568 | 0.81 | ITGA4 (0.63) | ITGA4ITGB1ITGB7 | |
| Firategrast SCHEMBL12002530 | 0.81 | ITGA4 (0.54) | ITGA4ITGB1ITGB7 | |
| SCHEMBL918862 | 0.81 | ITGA4 (0.63) | ITGA4ITGB1ITGB7 | |
| Firategrast SCHEMBL918399 | 0.81 | ITGA4 (0.54) | ITGA4ITGB1ITGB7 |
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-1478619-B1 | A PROCESS FOR PREPARING A PHENYLALANINE DERIVATIVE AND INTERMEDIATES THEREOF | MITSUBISHI TANABE PHARMA CORP (JP) | 2011-01-12 | — | — | EP | disclosed |