Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20178649 | 0.82 | ALDH1A1 (0.52) | ALDH1A1HDAC1HDAC6HDAC8HDAC3 | |
| SCHEMBL27795544 | 0.82 | CHRM2 (0.47) | ALDH1A1HDAC1HDAC6HDAC8HDAC3 | |
| SCHEMBL6816345 | 0.79 | ALDH1A1 (0.47) | ALDH1A1HDAC1HDAC6HDAC8HDAC3 | |
| SCHEMBL845803 | 0.77 | ALDH1A1 (0.56) | ALDH1A1HDAC1HDAC6HDAC8HDAC3 | |
| SCHEMBL28280822 | 0.75 | ALDH1A1 (0.57) | ALDH1A1HDAC1HDAC6HDAC3HDAC2 | |
| SCHEMBL20178650 | 0.75 | ACHE (0.54) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL30041535 | 0.74 | ALDH1A1 (0.58) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL2817935 | 0.74 | ALDH1A1 (0.58) | ALDH1A1PDK1PDK2PDK3PDK4 | |
| SCHEMBL1310717 | 0.74 | HDAC1 (0.49) | ALDH1A1HDAC1HDAC6HDAC8HDAC3 | |
| SCHEMBL4929256 | 0.72 | ALDH1A1 (0.57) | ALDH1A1PDK1PDK2PDK3PDK4 |
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-109563094-A | Acyclic derivatives, their preparation method and the pharmaceutical composition containing them that new (miscellaneous) aryl replaces | 法国施维雅药厂 | 2019-04-02 | — | — | CN | disclosed |