Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 19/20 | 0.54 |
| ▸ | ITGB3 | P05106 | 16/20 | 0.54 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.53 |
| ▸ | ITGB6 | P18564 | 10/20 | 0.48 |
| ▸ | ITGB5 | P18084 | 7/20 | 0.48 |
| ▸ | ITGB8 | P26012 | 7/20 | 0.48 |
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL20153337 | 0.87 | ITGAV (0.51) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL30195434 | 0.83 | ITGAV (0.63) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL25636886 | 0.83 | ITGAV (0.63) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL5856589 | 0.82 | ITGAV (0.56) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL6262063 | 0.81 | ITGB3 (0.74) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL13007683 | 0.81 | ITGAV (0.63) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL21340330 | 0.81 | ITGAV (0.60) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL8347928 | 0.80 | ITGAV (0.58) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| Hydrochloric Acid SCHEMBL6424214 | 0.80 | ITGB3 (0.72) | ITGAVITGB3ITGA2BITGB6ITGB5 | |
| SCHEMBL5847742 | 0.80 | ITGAV (0.56) | ITGAVITGB3ITGA2BITGB6ITGB5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3538525-B1 | 3-SUBSTITUTED PROPIONIC ACIDS AS ALPHA V INTEGRIN INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2022-06-22 | — | — | EP | disclosed |