Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDIA6 | Q15084 | 1/20 | 0.42 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 6/20 | 0.38 |
| ▸ | CA2 | P00918 | 6/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30839678 | 0.88 | CA1 (0.42) | PDIA6PTGES2CA1CA2CA12 | |
| SCHEMBL30839679 | 0.83 | PTGES2 (0.44) | PDIA6PTGES2CA1CA2CA12 | |
| SCHEMBL30839674 | 0.83 | PTGES2 (0.43) | PDIA6PTGES2CA1CA2CA12 | |
| SCHEMBL31148848 | 0.82 | PTGES2 (0.40) | PDIA6PTGES2CA1CA2CA12 | |
| SCHEMBL30839677 | 0.80 | ELANE (0.41) | PDIA6PTGES2CA1CA2CA12 | |
| SCHEMBL30839680 | 0.79 | MCL1 (0.41) | PTGES2CA1CA2CA12CA9 | |
| SCHEMBL12499026 | 0.74 | CA2 (0.43) | PDIA6CA1CA2CA12CA9 | |
| SCHEMBL3643588 | 0.73 | CA2 (0.48) | PDIA6CA1CA2CA12CA9 | |
| SCHEMBL1808208 | 0.71 | CA2 (0.47) | PDIA6CA1CA2CA12CA9 | |
| SCHEMBL29988503 | 0.70 | ALDH1A1 (0.43) | PDIA6CA1CA2CA12CA9 |
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-117417350-A | Preparation method of bridged ring compound containing dibenzoazacyclooctane structure | 四川大学 | 2024-01-19 | — | — | CN | disclosed |