Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 20/20 | 0.52 |
| ▸ | ITGAV | P06756 | 20/20 | 0.52 |
| ▸ | ITGB5 | P18084 | 6/20 | 0.47 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.46 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21937505 | 0.80 | ITGAV (0.54) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| SCHEMBL31446532 | 0.80 | ITGAV (0.53) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| SCHEMBL20158336 | 0.78 | ITGAV (0.52) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| SCHEMBL7380492 | 0.78 | ITGB3 (0.72) | ITGB3ITGAVITGA2B | |
| SCHEMBL20158231 | 0.76 | ITGAV (0.53) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| SCHEMBL7912615 | 0.76 | ITGB3 (0.79) | ITGB3ITGAVITGA2B | |
| SCHEMBL17640902 | 0.76 | ITGAV (0.52) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| SCHEMBL19384679 | 0.76 | ITGAV (0.52) | ITGB3ITGAVITGB5ITGB1ITGB6 | |
| Hydrochloric Acid SCHEMBL7910150 | 0.75 | ITGB3 (0.77) | ITGB3ITGAVITGA2B | |
| SCHEMBL4714404 | 0.75 | ITGB3 (0.52) | ITGB3ITGAVITGB5ITGB1ITGB6 |
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-0934305-A4 | INTEGRIN ANTAGONISTS | MERCK & CO INC (US) | 2001-04-11 | — | — | EP | claimed |
| EP-0934305-A1 | INTEGRIN ANTAGONISTS | Merck & Co., Inc. (US) | 1999-08-11 | — | — | EP | claimed |
| WO-1998008840-A1 | INTEGRIN ANTAGONISTS | MERCK & CO., INC. (US) | 1998-03-05 | — | — | WO | claimed |