Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.47 |
| ▸ | OGG1 | O15527 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23716154 | 0.84 | ROCK2 (0.48) | TRPM8OGG1ADRA1DSYKPARP1 | |
| SCHEMBL13710935 | 0.84 | ROCK2 (0.48) | TRPM8OGG1ADRA1DSYKPARP1 | |
| SCHEMBL13707890 | 0.83 | SYK (0.46) | ALDH1A1SMN1; SMN2TRPM8SYKPARP1 | |
| SCHEMBL13707909 | 0.81 | HDAC4 (0.47) | PARP1 | |
| SCHEMBL17664005 | 0.81 | S1PR3 (0.49) | SMN1; SMN2TRPM8OGG1ADRA1DSYK | |
| SCHEMBL13707899 | 0.80 | L3MBTL1 (0.55) | ALDH1A1SMN1; SMN2TRPM8PARP1 | |
| SCHEMBL13707881 | 0.80 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2TRPM8 | |
| SCHEMBL13707905 | 0.80 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2TRPM8 | |
| SCHEMBL2055566 | 0.78 | TRPM8 (0.52) | TRPM8OGG1ADRA1DPARP1 | |
| Hydrochloric Acid SCHEMBL4206593 | 0.78 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2TRPM8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7595299-B2 | Peptides as NS3-serine protease inhibitors of hepatitis C virus | SCHERING CORPORATION (US) | 2009-09-29 | — | — | US | disclosed |
| US-7169760-B2 | Peptides as NS3-serine protease inhibitors of hepatitis C virus | SCHERING CORPORATION (US) | 2007-01-30 | — | — | US | disclosed |