Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.51 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.51 |
| ▸ | F10 | P00742 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 8/20 | 0.41 |
| ▸ | ADH5 | P11766 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7230274 | 0.87 | ITGB3 (0.54) | ITGB3ITGA2BF10ALDH1A1GRM2 | |
| SCHEMBL6606264 | 0.82 | ITGB3 (0.58) | ITGB3ITGA2BF10ALDH1A1GRM2 | |
| SCHEMBL7309052 | 0.80 | THRB (0.43) | GRM2 | |
| SCHEMBL5637293 | 0.79 | GRM2 (0.42) | GRM2 | |
| SCHEMBL12728925 | 0.79 | GRM2 (0.60) | GRM2 | |
| SCHEMBL8695799 | 0.78 | GRM2 (0.59) | GRM2 | |
| SCHEMBL7292670 | 0.78 | GRM2 (0.59) | GRM2 | |
| SCHEMBL6957780 | 0.78 | GRM2 (0.57) | GRM2 | |
| SCHEMBL6960959 | 0.78 | GRM2 (0.57) | GRM2 | |
| SCHEMBL6966303 | 0.78 | GRM2 (0.59) | GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5627197-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-05-06 | — | — | US | disclosed |
| EP-0727425-A1 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1996-08-21 | — | — | EP | disclosed |