Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 14/20 | 0.52 |
| ▸ | ITGB1 | P05556 | 13/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7429111 | 0.92 | ITGA4 (0.59) | ITGA4ITGB1 | |
| SCHEMBL7426063 | 0.91 | ITGA4 (0.52) | ITGA4ITGB1MEN1KMT2ACHEK1 | |
| SCHEMBL7420147 | 0.89 | ITGA4 (0.57) | ITGA4ITGB1MEN1KMT2A | |
| SCHEMBL7423581 | 0.89 | ITGA4 (0.53) | ITGA4ITGB1MEN1KMT2ACHEK1 | |
| SCHEMBL7421450 | 0.88 | ITGA4 (0.55) | ITGA4ITGB1MEN1KMT2A | |
| SCHEMBL7427189 | 0.86 | ITGA4 (0.50) | ITGA4ITGB1MEN1KMT2A | |
| SCHEMBL7423534 | 0.85 | ITGA4 (0.53) | ITGA4ITGB1MEN1KMT2ACHEK1 | |
| SCHEMBL7422024 | 0.85 | ITGA4 (0.52) | ITGA4ITGB1MEN1KMT2ACHEK1 | |
| SCHEMBL7426345 | 0.84 | ITGA4 (0.52) | ITGA4ITGB1MEN1KMT2A | |
| SCHEMBL7430769 | 0.84 | ITGA4 (0.52) | ITGA4ITGB1MEN1KMT2ACHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999054321-A1 | SUBSTITUTED DIAMINES AND THEIR USE AS CELL ADHESION INHIBITORS | AVENTIS PHARMA LIMITED (GB) | 1999-10-28 | — | — | WO | disclosed |