Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 6/20 | 0.55 |
| ▸ | CTSS | P25774 | 3/20 | 0.49 |
| ▸ | CTSK | P43235 | 3/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL5351823 | 0.90 | CACNA1B (0.67) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL30089915 | 0.87 | CACNA1B (0.48) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL6842296 | 0.87 | CACNA1B (0.48) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL28628007 | 0.86 | CACNA1B (0.52) | CACNA1BCTSSCTSKHDAC4HDAC1 | |
| SCHEMBL16469897 | 0.86 | CACNA1B (0.52) | CACNA1BCTSSCTSKHDAC4HDAC1 | |
| SCHEMBL16330581 | 0.86 | CACNA1B (0.52) | CACNA1BCTSSCTSKHDAC4HDAC1 | |
| SCHEMBL192185 | 0.86 | CACNA1B (0.48) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL4233928 | 0.86 | CACNA1B (0.48) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL376117 | 0.86 | CACNA1B (0.48) | CACNA1BCTSSCTSKITGB3ITGA2B | |
| SCHEMBL16470235 | 0.85 | CACNA1B (0.51) | CACNA1BCTSSCTSKHDAC4HDAC1 |
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-116143744-A | Aromatic ester compound and application thereof | 陈艳莉 | 2023-05-23 | — | — | CN | disclosed |