Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 13/20 | 0.70 |
| ▸ | ITGA2 | P17301 | 7/20 | 0.70 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.63 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP7 | P09237 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4249877 | 0.92 | ITGB1 (0.71) | ITGB1ITGA2ITGA4FKBP1ACAPN1 | |
| SCHEMBL12084795 | 0.92 | ITGB1 (0.71) | ITGB1ITGA2ITGA4FKBP1ACAPN1 | |
| SCHEMBL4259018 | 0.86 | ITGB1 (0.66) | ITGB1ITGA2ITGA4FKBP1ACAPN1 | |
| SCHEMBL8245234 | 0.86 | ITGB1 (0.66) | ITGB1ITGA2ITGA4FKBP1ACAPN1 | |
| SCHEMBL1487410 | 0.85 | ITGB1 (0.75) | ITGB1ITGA2ITGA4FKBP1AITGAV | |
| SCHEMBL8239058 | 0.84 | ITGB1 (0.83) | ITGB1ITGA2ITGA4FKBP1AITGAV | |
| SCHEMBL12084502 | 0.84 | ITGB1 (0.83) | ITGB1ITGA2ITGA4FKBP1AITGAV | |
| SCHEMBL4255594 | 0.84 | ITGB1 (0.83) | ITGB1ITGA2ITGA4FKBP1AITGAV | |
| SCHEMBL12084791 | 0.83 | ITGB1 (0.79) | ITGB1ITGA2ITGA4FKBP1AITGAV | |
| SCHEMBL4260019 | 0.83 | ITGB1 (0.79) | ITGB1ITGA2ITGA4FKBP1AITGAV |
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-2006133338-A1 | INHIBITORS OF THE α2β1/GPIa-IIa INTEGRIN | THE TRUSTEES OF THE UNIVERSITY OF PENNESYLVANIA (US) | 2006-12-14 | — | — | WO | disclosed |