Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 4/20 | 0.76 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.76 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.76 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.76 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.76 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.76 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.76 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.76 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.76 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.76 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.76 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28926549 | 0.89 | HDAC3 (0.77) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL28644520 | 0.86 | HDAC6 (1.00) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL28657592 | 0.82 | HDAC3 (0.73) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL28642184 | 0.82 | HDAC3 (0.77) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL17072027 | 0.81 | HDAC3 (0.70) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL119739 | 0.80 | KMT2A (0.67) | MAPTLMNASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL119026 | 0.80 | KMT2A (0.71) | MAPTLMNASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28642043 | 0.80 | HDAC1 (0.82) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL10695214 | 0.80 | HDAC3 (0.62) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL120151 | 0.79 | KMT2A (0.73) | MAPTLMNASMN1; SMN2ALDH1A1POLB |
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-113582911-B | Multi-target donepezil-hydroxamic acid compound, and preparation method and application thereof | 山东大学 | 2024-03-12 | — | — | CN | disclosed |
| CN-113582911-A | Multi-target donepezil-hydroxamic acid type compound and preparation method and application thereof | 山东大学 | 2021-11-02 | — | — | CN | disclosed |