Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL7999307 | 0.92 | RELA (0.44) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL8002544 | 0.83 | RELA (0.44) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL8000869 | 0.83 | RELA (0.46) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL7998452 | 0.80 | RELA (0.49) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL8000744 | 0.80 | RELA (0.43) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL7990042 | 0.79 | RELA (0.47) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL8049300 | 0.77 | RELA (0.46) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL8000066 | 0.77 | RELA (0.46) | RELAMAOAMAOBALOX5PTGS1 | |
| SCHEMBL13845999 | 0.77 | APP (0.46) | MEN1KMT2ACACNA1BIDO1CYP4F2 | |
| SCHEMBL7999209 | 0.76 | PDE5A (0.39) | KDM4EMEN1ALDH1A1LMNAMAPT |
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-2009117594-A1 | FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2009-09-24 | — | — | WO | disclosed |