Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | MMP3 | P08254 | 2/20 | 0.32 |
| ▸ | MMP8 | P22894 | 2/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13686144 | 0.87 | — | — | |
| SCHEMBL13684406 | 0.86 | MMP1 (0.36) | MMP1MMP2MMP3MMP8MMP13 | |
| SCHEMBL13686134 | 0.86 | MMP1 (0.35) | MMP1MMP2MMP3MMP8MMP13 | |
| SCHEMBL13272865 | 0.80 | MMP1 (0.30) | MMP1MMP2MMP3MMP8 | |
| SCHEMBL13686136 | 0.80 | — | — | |
| SCHEMBL8051304 | 0.79 | CA1 (0.43) | — | |
| SCHEMBL12856121 | 0.75 | MMP1 (0.30) | MMP1MMP2MMP3MMP8MMP13 | |
| SCHEMBL8041801 | 0.75 | CCR6 (0.31) | — | |
| SCHEMBL13684449 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL13932142 | 0.74 | RRM1 (0.33) | MMP1MMP2MMP3 |
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-7592419-B2 | Macrocyclic inhibitors of hepatitis C virus NS3-serine protease | SCHERING CORPORATION (US) | 2009-09-22 | — | — | US | disclosed |