Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6600857 | 0.93 | ITGB3 (0.47) | ALDH1A1ITGB3ITGA2BSIGMAR1CASR | |
| SCHEMBL6602797 | 0.93 | ITGB3 (0.45) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL6601618 | 0.91 | ITGB3 (0.50) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL6600559 | 0.90 | ALDH1A1 (0.41) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL6606831 | 0.90 | ITGB3 (0.44) | ITGB3ITGA2BSIGMAR1F10GRM2 | |
| SCHEMBL6603919 | 0.89 | ITGB3 (0.42) | ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL7314580 | 0.89 | ALDH1A1 (0.47) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL6600975 | 0.88 | ITGB3 (0.43) | ALDH1A1ITGB3ITGA2BSIGMAR1CASR | |
| SCHEMBL6600555 | 0.88 | ITGB3 (0.43) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 | |
| SCHEMBL6604383 | 0.88 | ALDH1A1 (0.44) | ALDH1A1ITGB3ITGA2BSIGMAR1F10 |
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-0741133-B1 | Adhesion receptor antagonists | MERCK PATENT GMBH (DE) | 2004-01-28 | — | — | EP | disclosed |
| EP-0741133-A2 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1996-11-06 | — | — | EP | disclosed |