Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 9/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.36 |
| ▸ | FAP | Q12884 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 4/20 | 0.32 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16938900 | 0.88 | FAP (0.37) | HDAC1HDAC4HDAC6FAPHDAC3 | |
| SCHEMBL16938901 | 0.83 | HDAC1 (0.36) | HDAC1HDAC4HDAC6HDAC3 | |
| SCHEMBL12820226 | 0.81 | XIAP (0.35) | HDAC1HDAC4HDAC6NTSR1 | |
| SCHEMBL12467633 | 0.81 | PSMB9 (0.39) | HDAC1HDAC6HDAC3NTSR1 | |
| SCHEMBL16938911 | 0.81 | HDAC4 (0.31) | HDAC1HDAC4HDAC6 | |
| SCHEMBL16938889 | 0.78 | CTSB (0.40) | HDAC1HDAC4HDAC6FAP | |
| SCHEMBL16938957 | 0.77 | MMP3 (0.42) | HDAC1HDAC4HDAC6FAPHDAC3 | |
| SCHEMBL16938908 | 0.71 | TSHR (0.34) | HDAC1HDAC4HDAC6FAPHDAC3 | |
| SCHEMBL16938953 | 0.70 | GAA (0.33) | HDAC1HDAC4HDAC6FAP | |
| SCHEMBL16938903 | 0.70 | HDAC1 (0.38) | HDAC1HDAC4HDAC6FAPHDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2364310-B1 | 4-AMINO-4-OXOBUTANOYL PEPTIDE CYCLIC ANALOGUES, INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS INC (US) | 2015-07-29 | — | — | EP | disclosed |