Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.42 |
| ▸ | CPB2 | Q96IY4 | 11/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.36 |
| ▸ | MMP12 | P39900 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | ECE1 | P42892 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP14 | P50281 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL18762472 | 0.81 | ALDH1A1 (0.44) | ITGB3ITGAVCPB2ALDH1A1MMP12 | |
| SCHEMBL18762585 | 0.81 | ALDH1A1 (0.44) | ITGB3ITGAVCPB2ALDH1A1MMP12 | |
| Trifluoroacetic Acid SCHEMBL7953657 | 0.78 | ITGB1 (0.32) | ITGB3ITGAVCPB2ITGB1ITGA4 | |
| SCHEMBL1768677 | 0.73 | GRIK1 (0.40) | ALDH1A1MMP12MMP1MMP7ECE1 | |
| SCHEMBL1768679 | 0.73 | GRIK1 (0.40) | ALDH1A1MMP12MMP1MMP7ECE1 | |
| SCHEMBL29761845 | 0.73 | EPHX1 (0.37) | ITGB3ITGAVMMP12MMP1MMP7 | |
| SCHEMBL13448756 | 0.72 | MMP1 (0.37) | ITGB3ITGAVALDH1A1ITGB1ITGA4 | |
| SCHEMBL1768617 | 0.71 | GRIK1 (0.38) | MMP12MMP1MMP7ECE1MMP13 | |
| SCHEMBL15251846 | 0.71 | ALDH1A1 (0.46) | CPB2ALDH1A1MMP1MMP7MMP13 | |
| SCHEMBL1768620 | 0.71 | GRIK1 (0.38) | MMP12MMP1MMP7ECE1MMP13 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1098878-B1 | BISPIPERIDINES AS ANTITHROMBOTIC AGENTS | CEPHALON FRANCE (FR) | 2003-12-17 | — | — | EP | disclosed |
| EP-1098878-A1 | BISPIPERIDINES AS ANTITHROMBOTIC AGENTS | LABORATOIRE L. LAFON (FR) | 2001-05-16 | — | — | EP | disclosed |
| WO-2000003986-A1 | BISPIPERIDINES AS ANTITHROMBOTIC AGENTS | LABORATOIRE L. LAFON (FR) | 2000-01-27 | — | — | WO | disclosed |