Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 6/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7494122 | 0.81 | HDAC6 (0.49) | HDAC3HDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL7558736 | 0.79 | KLK7 (0.43) | ROCK2MAPTRAB9A | |
| SCHEMBL7502239 | 0.77 | LTA4H (0.45) | HDAC3HDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL7495177 | 0.76 | MAPT (0.46) | HDAC3HDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL7558043 | 0.76 | ROCK2 (0.43) | ROCK2JAK3 | |
| SCHEMBL7598334 | 0.76 | KMT2A (0.46) | ROCK2 | |
| SCHEMBL6508976 | 0.71 | KMT2A (0.67) | ROCK2MAPTHTTRAB9AJAK3 | |
| SCHEMBL7500121 | 0.71 | LTA4H (0.41) | HDAC3HDAC1HDAC8HDAC6HDAC2 | |
| SCHEMBL28282168 | 0.71 | CPN1 (0.42) | — | |
| SCHEMBL29829007 | 0.70 | EPHX2 (0.56) | HDAC3HDAC1HDAC8HDAC6HDAC2 |
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-2001092226-A1 | HETEROCYCLIC ANALGESIC COMPOUNDS AND METHOD OF USE THEREOF | SEPRACOR, INC. (US) | 2001-12-06 | — | — | WO | disclosed |