Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 15/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 14/20 | 0.46 |
| ▸ | ITGB6 | P18564 | 2/20 | 0.45 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.45 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 5/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31445490 | 0.84 | ITGAV (0.57) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL4717885 | 0.79 | CXCR4 (0.48) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL6921402 | 0.77 | ITGAV (0.46) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL12895016 | 0.76 | ITGAV (0.47) | ITGAVITGB3ITGB6ITGB5CXCR4 | |
| SCHEMBL4389523 | 0.74 | ITGAV (0.58) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL7797597 | 0.74 | ITGAV (0.51) | ITGAVITGB3ITGB6ITGB5CXCR4 | |
| SCHEMBL29416516 | 0.73 | ITGAV (0.54) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL21328658 | 0.73 | ITGAV (0.54) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL3138678 | 0.73 | ITGAV (0.54) | ITGAVITGB3ITGB6ITGB5ITGB8 | |
| SCHEMBL326631 | 0.73 | ITGB3 (0.47) | ITGAVITGB3ITGB6ITGB5ITGB8 |
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-2049494-A2 | TYROSINE KINASE INHIBITORS | Merck & Co., Inc. (US) | 2009-04-22 | — | — | EP | claimed |
| WO-2008008310-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2008-01-17 | — | — | WO | claimed |