Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 20/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 13/20 | 0.45 |
| ▸ | ITGB5 | P18084 | 11/20 | 0.45 |
| ▸ | ITGB1 | P05556 | 6/20 | 0.42 |
| ▸ | ITGB6 | P18564 | 12/20 | 0.42 |
| ▸ | ITGB8 | P26012 | 5/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7017295 | 0.87 | ITGAV (0.43) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL7012378 | 0.81 | ITGAV (0.49) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL7397461 | 0.78 | ITGAV (0.47) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL22893988 | 0.78 | ITGAV (0.46) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL30335954 | 0.76 | ITGAV (0.47) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL7007445 | 0.76 | ITGAV (0.47) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL7005713 | 0.76 | ITGAV (0.41) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| Hydrochloric Acid SCHEMBL20481212 | 0.75 | ITGAV (0.47) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL7403607 | 0.75 | ITGAV (0.54) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL20139919 | 0.75 | ITGAV (0.46) | ITGAVITGB3ITGB5ITGB1ITGB6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0946165-B1 | INTEGRIN ANTAGONISTS | MERCK & CO INC (US) | 2003-04-09 | — | — | EP | disclosed |
| EP-0946165-A4 | INTEGRIN ANTAGONISTS | MERCK & CO INC (US) | 2001-04-11 | — | — | EP | disclosed |
| EP-0946165-A1 | INTEGRIN ANTAGONISTS | Merck & Co., Inc. (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998018460-A1 | INTEGRIN ANTAGONISTS | MERCK & CO., INC. (US) | 1998-05-07 | — | — | WO | disclosed |