Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 11/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 11/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 11/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 11/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 10/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 10/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | PHGDH | O43175 | 4/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28124043 | 0.89 | HDAC6 (0.50) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28123450 | 0.83 | HDAC3 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28013853 | 0.81 | HDAC6 (0.60) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28124048 | 0.81 | HDAC6 (0.60) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28014600 | 0.80 | HDAC6 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28013855 | 0.80 | HDAC6 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28123442 | 0.79 | HDAC6 (0.58) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28838815 | 0.79 | HDAC6 (0.58) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28838809 | 0.79 | HDAC6 (0.58) | HDAC6HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL28124052 | 0.77 | HDAC6 (0.56) | HDAC6HDAC3HDAC4HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104592116-B | 1,3,5-trisubstituted pyrazole compounds, and preparation method and application thereof | 山东大学 | 2017-01-11 | — | — | CN | claimed |
| CN-104592116-B | 1,3,5-trisubstituted pyrazole compounds, and preparation method and application thereof | 山东大学 | 2017-01-11 | — | — | CN | disclosed |