Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12323193 | 0.97 | HDAC8 (0.67) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL23091318 | 0.87 | MAPT (0.57) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL12116519 | 0.82 | HDAC8 (0.56) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL31185001 | 0.82 | MAPT (0.61) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL12323611 | 0.80 | ALDH1A1 (0.59) | HDAC8HDAC6MAPTHTTEPHX1 | |
| SCHEMBL21733423 | 0.80 | MAPT (0.50) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL7056987 | 0.80 | HDAC8 (0.67) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL2446419 | 0.79 | — | — | |
| SCHEMBL26188318 | 0.79 | HDAC8 (0.58) | HDAC8HDAC6MAPTHTTCES2 | |
| SCHEMBL21441786 | 0.79 | HDAC8 (0.58) | HDAC8HDAC6MAPTHTTCES2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111032651-A | Heterocyclic compounds | 武田药品工业株式会社 | 2020-04-17 | — | — | CN | disclosed |