Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | VNN1 | O95497 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | PREP | P48147 | 1/20 | 0.41 |
| ▸ | FAP | Q12884 | 1/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RHOC | P08134 | 1/20 | 0.41 |
| ▸ | RHOA | P61586 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL844960 | 0.90 | DPP4 (0.43) | ROCK2CYP2C9CYP2C19VNN1ALDH1A1 | |
| SCHEMBL872436 | 0.90 | DPP4 (0.43) | ROCK2CYP2C9CYP2C19VNN1ALDH1A1 | |
| SCHEMBL845297 | 0.90 | RHOC (0.48) | ROCK2CYP2C9CYP2C19VNN1MAPK1 | |
| SCHEMBL845231 | 0.89 | HCRTR1 (0.43) | ROCK2CYP2C9CYP2C19VNN1ALDH1A1 | |
| SCHEMBL845206 | 0.86 | CYP2C9 (0.52) | CYP2C9CYP2C19MAPK1ALDH1A1HTT | |
| SCHEMBL845461 | 0.85 | PREP (0.44) | ROCK2CYP2C9CYP2C19VNN1PREP | |
| SCHEMBL845234 | 0.85 | RHOC (0.43) | ROCK2CYP2C9CYP2C19VNN1ALDH1A1 | |
| SCHEMBL845478 | 0.82 | NPC1 (0.43) | ROCK2CYP2C9CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL10119294 | 0.82 | ITGB3 (0.41) | ROCK2VNN1ALDH1A1DPP4PREP | |
| SCHEMBL845338 | 0.79 | RHOC (0.48) | ROCK2CYP2C9CYP2C19ALDH1A1KMT2A |
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 |