Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12855972 | 1.00 | GAA (0.31) | GAACYP2C9CYP2C19EPHX1 | |
| SCHEMBL8290334 | 0.87 | ANPEP (0.30) | — | |
| SCHEMBL12607111 | 0.84 | — | — | |
| SCHEMBL8290607 | 0.84 | — | — | |
| SCHEMBL12608390 | 0.84 | — | — | |
| SCHEMBL8046504 | 0.83 | — | — | |
| SCHEMBL16349737 | 0.83 | — | — | |
| SCHEMBL8290345 | 0.82 | — | — | |
| SCHEMBL12608386 | 0.82 | — | — | |
| SCHEMBL8291430 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009058856-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |