Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 1/20 | 0.45 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.45 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.45 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13622666 | 1.00 | PER2 (0.45) | PER2CRY1CRY2CACNA1HKCNH2 | |
| SCHEMBL8036660 | 0.81 | CTSK (0.34) | NAMPTPPARACTSKPPARGATM | |
| SCHEMBL13622653 | 0.81 | CTSK (0.34) | NAMPTPPARACTSKPPARGATM | |
| SCHEMBL8270195 | 0.81 | PER2 (0.49) | PER2CRY1CRY2CACNA1HKCNH2 | |
| SCHEMBL13622671 | 0.76 | TPSAB1 (0.54) | TDP1 | |
| SCHEMBL8282041 | 0.76 | TPSAB1 (0.54) | TDP1 | |
| SCHEMBL13622796 | 0.74 | KDM4E (0.44) | PER2CRY2NAMPTCTSKCTSS | |
| SCHEMBL13622813 | 0.74 | KDM4E (0.44) | PER2CRY2NAMPTCTSKCTSS | |
| SCHEMBL8282107 | 0.74 | KDM4E (0.44) | PER2CRY2NAMPTCTSKCTSS | |
| SCHEMBL8242189 | 0.73 | PER2 (0.51) | PER2CRY1CRY2CACNA1HKCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1730142-B1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORP (US) | 2011-06-29 | — | — | EP | disclosed |
| WO-2005085242-A1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORPORATION (US) | 2005-09-15 | — | — | WO | disclosed |