Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 10/20 | 0.38 |
| ▸ | MMP9 | P14780 | 3/20 | 0.38 |
| ▸ | MMP13 | P45452 | 3/20 | 0.38 |
| ▸ | MMP2 | P08253 | 8/20 | 0.38 |
| ▸ | MMP3 | P08254 | 7/20 | 0.37 |
| ▸ | PDE4A | P27815 | 7/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1601535 | 0.80 | HTT (0.37) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1602562 | 0.80 | HTT (0.37) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1601959 | 0.79 | MMP2 (0.47) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1601956 | 0.78 | SPPL2A (0.44) | — | |
| SCHEMBL6617619 | 0.75 | MMP1 (0.45) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1602659 | 0.72 | MMP2 (0.50) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1602254 | 0.72 | MMP2 (0.48) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL1601222 | 0.71 | MMP2 (0.46) | MMP1MMP9MMP13MMP2MMP3 | |
| SCHEMBL12709147 | 0.71 | SPPL2A (0.44) | — | |
| SCHEMBL7563179 | 0.71 | HTT (0.43) | MMP1MMP9MMP13MMP2CA2 |
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-1637518-A2 | Inhibitors of aspartyl protease | Vertex Pharmaceuticals Incorporated (US) | 2006-03-22 | — | — | EP | disclosed |