Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 11/20 | 0.50 |
| ▸ | MMP9 | P14780 | 9/20 | 0.50 |
| ▸ | MMP13 | P45452 | 8/20 | 0.50 |
| ▸ | MMP2 | P08253 | 6/20 | 0.44 |
| ▸ | MMP3 | P08254 | 5/20 | 0.44 |
| ▸ | PTPRB | P23467 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 3/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MMP7 | P09237 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559637 | 0.71 | MMP13 (0.72) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL5771968 | 0.70 | MMP1 (0.44) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL8139629 | 0.70 | ALDH1A1 (0.49) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL6932195 | 0.69 | MMP13 (0.63) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL8843503 | 0.69 | MMP1 (0.52) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL8713231 | 0.69 | MMP1 (0.73) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL6930656 | 0.68 | MMP1 (0.77) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL6929880 | 0.68 | MMP1 (0.76) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL6928874 | 0.67 | MMP1 (1.00) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL6928756 | 0.67 | MMP13 (0.57) | MMP1MMP9MMP13MMP2MMP3 |
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-1086076-B1 | SULFONAMIDE INHIBITORS OF ASPARTYL PROTEASE | VERTEX PHARMA (US) | 2004-12-22 | — | — | EP | disclosed |