Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 2/20 | 0.58 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.58 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | PLAU | P00749 | 1/20 | 0.52 |
| ▸ | HPN | P05981 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6151162 | 1.00 | ITGA4 (0.58) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6709564 | 0.91 | ITGA4 (0.57) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6710636 | 0.91 | ITGA4 (0.57) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6710949 | 0.90 | GAA (0.60) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL5496192 | 0.89 | ITGA4 (0.56) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6709431 | 0.89 | GAA (0.54) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6714713 | 0.88 | GAA (0.58) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6714791 | 0.88 | GAA (0.58) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6400256 | 0.88 | GAA (0.58) | ITGA4ITGB1ITGA2GAAHPGD | |
| SCHEMBL6400260 | 0.88 | GAA (0.58) | ITGA4ITGB1ITGA2GAAHPGD |
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-1495044-A1 | HETEROCYCLIC AMIDES WITH ALPHA-4 INTEGRIN ANTAGONIST ACTIVITY | J. Uriach y Compania S.A. (ES) | 2005-01-12 | — | — | EP | disclosed |
| WO-2003084984-A1 | HETEROCYCLIC AMIDES WITH ALPHA-4 INTEGRIN ANTAGONIST ACTIVITY | J. URIACH Y COMPANIA S.A. (ES) | 2003-10-16 | — | — | WO | disclosed |