Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 2/20 | 0.47 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.47 |
| ▸ | ITGAL | P20701 | 2/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.45 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806998 | 0.86 | ITGB2 (0.62) | ITGB2ICAM1ITGALSLC6A5CYP3A4 | |
| SCHEMBL13187470 | 0.86 | ITGB2 (0.49) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL10122812 | 0.84 | ITGB2 (0.47) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL888751 | 0.84 | ITGB2 (0.47) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL19364755 | 0.83 | HRH3 (0.48) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL8906903 | 0.83 | HRH3 (0.47) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL19364630 | 0.81 | HRH3 (0.50) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL10031610 | 0.81 | SLC6A5 (0.53) | ITGB2ICAM1ITGALHRH3HRH4 | |
| SCHEMBL14886286 | 0.78 | MME (0.31) | — | |
| SCHEMBL23787478 | 0.78 | QPCT (0.53) | ITGB2ICAM1ITGALSLC6A5CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010148006-A1 | HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2010-12-23 | — | — | WO | disclosed |