Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL845195 | 0.91 | HCRTR1 (0.46) | GAAMAPK1HCRTR1HCRTR2PABPC1 | |
| SCHEMBL845190 | 0.91 | EPHX2 (0.42) | MAPK1EPHX2CYP3A4ITGB1ITGA4 | |
| SCHEMBL845393 | 0.89 | GAA (0.47) | GAAMAPK1HCRTR1HCRTR2PABPC1 | |
| SCHEMBL845086 | 0.88 | EPHX2 (0.40) | EPHX2CYP3A4ALDH1A1KDM4EITGB1 | |
| SCHEMBL845286 | 0.87 | ALDH1A1 (0.48) | GAAHCRTR1HCRTR2PABPC1LMNA | |
| SCHEMBL845334 | 0.83 | ITGB1 (0.39) | EPHX2CYP3A4ITGB1ITGA4 | |
| SCHEMBL10119279 | 0.83 | EPHX2 (0.37) | MAPK1EPHX2CYP3A4ITGB1ITGA4 | |
| SCHEMBL10119337 | 0.77 | ADRB1 (0.36) | EPHX2CYP3A4ITGB1ITGA4 | |
| SCHEMBL15116912 | 0.77 | ALDH1A1 (0.56) | MAPK1HCRTR1HCRTR2PABPC1LMNA | |
| SCHEMBL845205 | 0.77 | ALDH1A1 (0.56) | MAPK1HCRTR1HCRTR2PABPC1LMNA |
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-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |