Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 14/20 | 0.40 |
| ▸ | HTR2B | P41595 | 3/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7304501 | 0.95 | ITGB3 (0.45) | ITGB3ITGA2BSIGMAR1HTR2BROCK2 | |
| SCHEMBL7304816 | 0.94 | ITGB3 (0.40) | ITGB3ITGA2BSIGMAR1 | |
| SCHEMBL7671038 | 0.91 | ITGB3 (0.41) | ITGB3ITGA2BSIGMAR1 | |
| SCHEMBL7317424 | 0.91 | ITGB3 (0.45) | ITGB3ITGA2BSIGMAR1HTR2BROCK2 | |
| SCHEMBL7308092 | 0.90 | ITGB3 (0.44) | ITGB3ITGA2BSIGMAR1HTR2B | |
| SCHEMBL8858197 | 0.90 | ITGB3 (0.41) | ITGB3ITGA2BSIGMAR1HTR2BROCK2 | |
| SCHEMBL7316965 | 0.89 | ITGB3 (0.44) | ITGB3ITGA2BSIGMAR1 | |
| SCHEMBL7306839 | 0.88 | ITGB3 (0.43) | ITGB3ITGA2BSIGMAR1 | |
| SCHEMBL7632371 | 0.87 | ITGB3 (0.39) | ITGB3ITGA2BSIGMAR1 | |
| SCHEMBL7318763 | 0.85 | ITGB3 (0.43) | ITGB3ITGA2BSIGMAR1 |
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-0741133-A2 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1996-11-06 | — | — | EP | disclosed |