Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 18/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 16/20 | 0.49 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.43 |
| ▸ | ITGB6 | P18564 | 4/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.42 |
| ▸ | ITGB8 | P26012 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20156008 | 0.79 | ITGAV (0.53) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL20156256 | 0.76 | ITGB3 (0.52) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL30471830 | 0.73 | ITGB3 (0.67) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL760607 | 0.72 | ITGB3 (0.69) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL20156094 | 0.72 | ITGAV (0.49) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL20156312 | 0.72 | ITGAV (0.52) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| Hydrochloric Acid SCHEMBL3138978 | 0.72 | CXCR4 (0.58) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL24194365 | 0.71 | ITGAV (0.59) | ITGAVITGB3ITGB5ITGA2BITGB6 | |
| SCHEMBL20156009 | 0.71 | CXCR4 (0.47) | ITGAVITGB3ITGB5ITGB6CXCR4 | |
| SCHEMBL13007683 | 0.70 | ITGAV (0.63) | ITGAVITGB3ITGB5ITGA2BITGB6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018089358-A1 | AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |