Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 8/20 | 0.42 |
| ▸ | TACR2 | P21452 | 7/20 | 0.42 |
| ▸ | MMP9 | P14780 | 4/20 | 0.41 |
| ▸ | MMP8 | P22894 | 3/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.41 |
| ▸ | ITGAL | P20701 | 1/20 | 0.41 |
| ▸ | GHSR | Q92847 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8343307 | 0.89 | ITGB2 (0.50) | MMP9ITGB2ICAM1ITGALGHSR | |
| SCHEMBL8345542 | 0.88 | TACR1 (0.55) | TACR1TACR2 | |
| SCHEMBL8343109 | 0.88 | TACR1 (0.55) | TACR1TACR2 | |
| SCHEMBL8346929 | 0.85 | TACR1 (0.56) | TACR1TACR2GHSR | |
| SCHEMBL8346758 | 0.84 | TACR1 (0.51) | TACR1TACR2MMP9MMP8GHSR | |
| SCHEMBL8349377 | 0.84 | TACR1 (0.48) | TACR1TACR2MMP9MMP8MMP14 | |
| SCHEMBL8346990 | 0.84 | TACR1 (0.53) | TACR1TACR2 | |
| SCHEMBL8348040 | 0.83 | TACR1 (0.51) | TACR1TACR2 | |
| SCHEMBL8345132 | 0.82 | TACR1 (0.53) | TACR1TACR2MMP9MMP8MMP14 | |
| SCHEMBL8344898 | 0.81 | TACR1 (0.52) | TACR1TACR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5869489-A | TREATMENT OF INFLAMMATORY DISEASES, MIGRAINES AND ASTHMA | MERCK & CO., INC. (US) | 1999-02-09 | — | — | US | disclosed |