Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 15/20 | 0.54 |
| ▸ | ITGB1 | P05556 | 14/20 | 0.54 |
| ▸ | ITGB7 | P26010 | 11/20 | 0.54 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.44 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.44 |
| ▸ | ITGAL | P20701 | 2/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.44 |
| ▸ | ALB | P02768 | 1/20 | 0.43 |
| ▸ | IL2 | P60568 | 1/20 | 0.43 |
| ▸ | KIFC1 | Q9BW19 | 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 | |
|---|---|---|---|---|
| Firategrast SCHEMBL918399 | 0.93 | ITGA4 (0.54) | ITGA4ITGB1ITGB7ALBIL2 | |
| Firategrast SCHEMBL12002530 | 0.93 | ITGA4 (0.54) | ITGA4ITGB1ITGB7ALBIL2 | |
| Firategrast SCHEMBL1681763 | 0.91 | ITGA4 (0.53) | ITGA4ITGB1ITGB7ALBIL2 | |
| SCHEMBL27499526 | 0.87 | ITGA4 (0.56) | ITGA4ITGB1ITGB7ITGB3ITGAV | |
| SCHEMBL919212 | 0.87 | ITGA4 (0.56) | ITGA4ITGB1ITGB7ITGB3ITGAV | |
| SCHEMBL12943224 | 0.87 | ITGA4 (0.51) | ITGA4ITGB1ITGB7ITGB2ICAM1 | |
| SCHEMBL919328 | 0.85 | ITGA4 (0.53) | ITGA4ITGB1ITGB7ALBIL2 | |
| SCHEMBL920095 | 0.85 | ITGA4 (0.46) | ITGA4ITGB1ITGB7 | |
| SCHEMBL920937 | 0.84 | ITGA4 (0.47) | ITGA4ITGB1ITGB7 | |
| SCHEMBL920085 | 0.84 | ITGA4 (0.57) | ITGA4ITGB1ITGB7ALBIL2 |
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-1478619-A1 | A PROCESS FOR PREPARING A PHENYLALANINE DERIVATIVE AND INTERMEDIATES THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 2004-11-24 | — | — | EP | disclosed |
| WO-2003072536-A1 | A PROCESS FOR PREPARING A PHENYLALANINE DERIVATIVE AND INTERMEDIATES THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 2003-09-04 | — | — | WO | disclosed |