Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 10/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.33 |
| ▸ | PPIA | P62937 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8054549 | 0.87 | PPIA (0.33) | HDAC4HDAC1PPIAHDAC6HDAC3 | |
| SCHEMBL8290722 | 0.85 | CTSD (0.34) | HDAC4HDAC1HDAC6HDAC3HDAC7 | |
| SCHEMBL12607958 | 0.84 | — | — | |
| SCHEMBL8059830 | 0.80 | PSMB9 (0.39) | HDAC4HDAC1PPIAHDAC6HDAC3 | |
| SCHEMBL16349811 | 0.75 | F2 (0.42) | HDAC4HDAC1HDAC6 | |
| SCHEMBL8291503 | 0.75 | F2 (0.41) | HDAC4HDAC1HDAC6HDAC3 | |
| SCHEMBL16349814 | 0.74 | — | — | |
| SCHEMBL16349801 | 0.74 | — | — | |
| SCHEMBL8291443 | 0.74 | F2 (0.43) | HDAC4HDAC1HDAC6 | |
| SCHEMBL8291441 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009058856-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |
| WO-2005030796-A1 | MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORPORATION (US) | 2005-04-07 | — | — | WO | disclosed |