Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 4/20 | 0.48 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.48 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.37 |
| ▸ | ITK | Q08881 | 4/20 | 0.36 |
| ▸ | FLT3 | P36888 | 4/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14591889 | 0.77 | EPHB3 (0.56) | ITGB1ITGA4EPHB3CSNK2A1FLT3 | |
| SCHEMBL2432131 | 0.76 | EPHB3 (0.60) | ITGB1ITGA4EPHB3CSNK2A1ITK | |
| SCHEMBL14626754 | 0.75 | EPHB3 (0.58) | ITGB1ITGA4EPHB3CSNK2A1FLT3 | |
| SCHEMBL14592698 | 0.74 | ITGB1 (0.56) | ITGB1ITGA4EPHB3CSNK2A1FLT3 | |
| SCHEMBL2432642 | 0.70 | EPHB3 (0.54) | ITGB1ITGA4EPHB3CSNK2A1ITK | |
| SCHEMBL14592686 | 0.65 | ITGA4 (1.00) | ITGB1ITGA4 | |
| SCHEMBL2432310 | 0.64 | ITGB1 (0.62) | ITGB1ITGA4EPHB3CSNK2A1HRH1 | |
| SCHEMBL14592709 | 0.64 | ITGA4 (0.88) | ITGB1ITGA4 | |
| SCHEMBL2432892 | 0.64 | ITGB1 (0.54) | ITGB1ITGA4EPHB3CSNK2A1FLT3 | |
| SCHEMBL14591879 | 0.62 | ITGB1 (0.54) | ITGB1ITGA4SMN1; SMN2 |
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-1346982-B1 | VLA-4 INHIBITORS | DAIICHI SEIYAKU CO (JP) | 2011-09-14 | — | — | EP | disclosed |