Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 4/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 4/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 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 | |
|---|---|---|---|---|
| SCHEMBL7304473 | 0.91 | ITGB3 (0.47) | ITGB3ITGA2BSIGMAR1ALDH1A1KMT2A | |
| SCHEMBL7312359 | 0.91 | ITGB3 (0.50) | ITGB3ITGA2BSIGMAR1KMT2AF10 | |
| SCHEMBL7314740 | 0.85 | ITGB3 (0.51) | ITGB3ITGA2BSIGMAR1ALDH1A1KMT2A | |
| SCHEMBL7315130 | 0.84 | ITGB3 (0.42) | ITGB3ITGA2BSIGMAR1F10F2 | |
| SCHEMBL7314728 | 0.84 | ITGB3 (0.45) | ITGB3ITGA2BSIGMAR1F10F2 | |
| SCHEMBL7309533 | 0.83 | ITGB3 (0.46) | ITGB3ITGA2BSIGMAR1F10F2 | |
| SCHEMBL7311098 | 0.82 | ITGB3 (0.48) | ITGB3ITGA2BSIGMAR1F10F2 | |
| SCHEMBL7632371 | 0.81 | ITGB3 (0.39) | ITGB3ITGA2BCYP3A4CYP2D6SIGMAR1 | |
| SCHEMBL7633348 | 0.81 | ITGB3 (0.41) | ITGB3ITGA2BCYP3A4CYP2D6SIGMAR1 | |
| SCHEMBL7314982 | 0.78 | ITGB3 (0.42) | ITGB3ITGA2BCYP3A4CYP2D6SIGMAR1 |
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 |