Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.43 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PORCN | Q9H237 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL13272509 | 1.00 | TRPV1 (0.45) | TRPV1CYP2C9CYP2C19HCRTR2DGAT1 | |
| SCHEMBL845704 | 0.95 | TRPV1 (0.48) | TRPV1CYP2C9CYP2C19HCRTR2DGAT1 | |
| SCHEMBL845699 | 0.92 | RHOC (0.48) | DGAT1HTTHCRTR1 | |
| SCHEMBL845114 | 0.89 | EP300 (0.46) | TRPV1DGAT1ALDH1A1HTTLMNA | |
| SCHEMBL845640 | 0.89 | ALDH1A1 (0.49) | TRPV1HCRTR2ROCK2ALDH1A1HCRTR1 | |
| SCHEMBL10119343 | 0.88 | ALDH1A1 (0.44) | CYP2C9CYP2C19HCRTR2DGAT1PABPC1 | |
| SCHEMBL10119346 | 0.88 | RHOC (0.45) | HCRTR2DGAT1ALDH1A1HCRTR1 | |
| SCHEMBL13272491 | 0.87 | TRPV1 (0.38) | TRPV1CYP2C9CYP2C19HCRTR2DGAT1 | |
| SCHEMBL845442 | 0.86 | CYP2C9 (0.43) | TRPV1CYP2C9CYP2C19PABPC1ALDH1A1 | |
| SCHEMBL845374 | 0.86 | PABPC1 (0.51) | CYP2C9CYP2C19HCRTR2DGAT1PABPC1 |
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 3 patents. 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 |
| US-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |
| EP-1893573-B1 | INHIBITORS OF HCV REPLICATION | BRISTOL MYERS SQUIBB CO (US) | 2010-07-21 | — | — | EP | disclosed |