Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RHOC | P08134 | 1/20 | 0.36 |
| ▸ | RHOA | P61586 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL845026 | 0.92 | CYP2C9 (0.43) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL872532 | 0.87 | TRPV1 (0.44) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL874056 | 0.84 | TRPV1 (0.42) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL873862 | 0.82 | ALDH1A1 (0.45) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL10119502 | 0.82 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL10119315 | 0.82 | MAPT (0.40) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL874324 | 0.82 | MAPK1 (0.42) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL10119344 | 0.82 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL13272389 | 0.82 | TRPV1 (0.36) | CYP2C9CYP2C19TRPV1ALDH1A1MAPK1 | |
| SCHEMBL874313 | 0.81 | MAPK1 (0.50) | CYP2C9CYP2C19ALDH1A1MAPK1HTT |
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 |