Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 4/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3836320 | 0.93 | ITGB1 (0.36) | ITGB1ITGA4 | |
| SCHEMBL3833596 | 0.90 | MEN1 (0.32) | ITGB1ITGA4MEN1NPC1RAB9A | |
| SCHEMBL3833845 | 0.89 | ITGB1 (0.38) | ITGB1ITGA4 | |
| SCHEMBL3833793 | 0.88 | ITGB1 (0.38) | ITGB1ITGA4 | |
| SCHEMBL3836800 | 0.86 | ITGB1 (0.34) | ITGB1ITGA4 | |
| SCHEMBL3832798 | 0.86 | ITGB1 (0.38) | ITGB1ITGA4 | |
| SCHEMBL6131672 | 0.86 | ITGB1 (0.38) | ITGB1ITGA4 | |
| SCHEMBL3884133 | 0.85 | ITGB1 (0.58) | ITGB1ITGA4 | |
| SCHEMBL2978337 | 0.85 | ITGB1 (0.58) | ITGB1ITGA4 | |
| SCHEMBL3836404 | 0.82 | ITGB1 (0.42) | ITGB1ITGA4 |
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-1780201-A2 | PHENYLALANINE ENAMIDE DERIVATIVES POSSESSING A CYCLOBUTENE GROUP, FOR USE AS INTEGRIN INHIBITORS | Celltech R&D Limited (GB) | 2007-05-02 | — | — | EP | disclosed |