Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CCR6 | P51684 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28113165 | 0.89 | ALDH1A1 (0.46) | HTTALDH1A1CCR6PAX8KMT2A | |
| SCHEMBL20794168 | 0.87 | ALDH1A1 (0.49) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL17747886 | 0.87 | CCR6 (0.48) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL12130679 | 0.84 | KMT2A (0.50) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL18154139 | 0.84 | ALDH1A1 (0.49) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL6991879 | 0.82 | ALDH1A1 (0.50) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL393422 | 0.81 | HTT (0.52) | HTTALDH1A1CCR6PAX8KMT2A | |
| SCHEMBL13684205 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CCR6PAX8KMT2AMEN1 | |
| SCHEMBL3799136 | 0.80 | HTT (0.46) | HTTALDH1A1CCR6PAX8MAPK1 | |
| SCHEMBL17956525 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CCR6PAX8KMT2AMEN1 |
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-102020574-B | Derivant of propofol γ-aminobutyric acid ester and preparation method thereof | Zhong Shanwanhan Pharmaceutical Technology Co., Ltd (CN) | 2016-12-14 | — | — | CN | disclosed |