Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 6/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.45 |
| ▸ | CTSS | P25774 | 2/20 | 0.45 |
| ▸ | NAAA | Q02083 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29050983 | 1.00 | CACNA1B (0.53) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL26895103 | 0.99 | CACNA1B (0.53) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL30044916 | 0.94 | CACNA1B (0.55) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL30089915 | 0.90 | CACNA1B (0.48) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL6842296 | 0.90 | CACNA1B (0.48) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL6842295 | 0.90 | CACNA1B (0.51) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL20524880 | 0.90 | CACNA1B (0.51) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL19296747 | 0.90 | CACNA1B (0.51) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL192185 | 0.89 | CACNA1B (0.48) | CACNA1BHDAC4HDAC1HDAC6CTSK | |
| SCHEMBL4233928 | 0.89 | CACNA1B (0.48) | CACNA1BHDAC4HDAC1HDAC6CTSK |
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-116600830-A | Conjugated TLR7 and NOD2 agonists | 卢布尔雅那大学 | 2023-08-15 | — | — | CN | disclosed |