Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 20/20 | 0.74 |
| ▸ | ITGA4 | P13612 | 20/20 | 0.74 |
| ▸ | ITGB7 | P26010 | 20/20 | 0.74 |
| ▸ | ITGAV | P06756 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL2957798 | 0.92 | ITGB1 (0.78) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL2957040 | 0.92 | ITGB1 (0.78) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL13671316 | 0.90 | ITGB1 (0.80) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL2926949 | 0.90 | ITGB1 (0.80) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL2962382 | 0.90 | ITGB1 (0.80) | ITGB1ITGA4ITGB7ITGAV | |
| Hydrochloric Acid SCHEMBL2961791 | 0.90 | ITGB1 (0.79) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL2951232 | 0.87 | ITGB1 (0.88) | ITGB1ITGA4ITGB7ITGAV | |
| SCHEMBL2846116 | 0.85 | ITGB1 (1.00) | ITGB1ITGA4ITGB7 | |
| SCHEMBL2846069 | 0.85 | ITGB1 (1.00) | ITGB1ITGA4ITGB7 | |
| SCHEMBL2959524 | 0.85 | ITGB1 (0.79) | ITGB1ITGA4ITGB7ITGAV |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1507775-A4 | HETEROCYCLIC COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY ALPHA4 INTEGRINS | ELAN PHARM INC (US) | 2006-05-24 | — | — | EP | disclosed |
| EP-1507775-A1 | HETEROCYCLIC COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY ALPHA4 INTEGRINS | Elan Pharmaceuticals, Inc. (US) | 2005-02-23 | — | — | EP | disclosed |
| WO-2003099809-A1 | HETEROCYCLIC COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY α4 INTEGRINS | ELAN PHARMACEUTICALS, INC. (US) | 2003-12-04 | — | — | WO | disclosed |