Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 13/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.37 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.37 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.37 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29017380 | 1.00 | P2RX7 (0.47) | P2RX7ALDH1A1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9804270 | 0.87 | SLC6A4 (0.44) | P2RX7ALDH1A1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL29017386 | 0.83 | SLC6A3 (0.42) | P2RX7SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL29017358 | 0.83 | OPRM1 (0.45) | P2RX7ALDH1A1SLC6A3SLC6A2 | |
| SCHEMBL29017384 | 0.83 | P2RX7 (0.40) | P2RX7ALDH1A1PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL29017400 | 0.83 | OPRM1 (0.45) | P2RX7ALDH1A1SLC6A3SLC6A2 | |
| SCHEMBL29017365 | 0.83 | P2RX7 (0.40) | P2RX7ALDH1A1PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL29017330 | 0.83 | SLC6A3 (0.42) | P2RX7SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL19297312 | 0.83 | SLC6A4 (0.59) | P2RX7ALDH1A1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL29017378 | 0.82 | MAOA (0.42) | ALDH1A1 |
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-116240194-B | Limonene epoxy hydrolase mutant and catalytic synthesis of chiral oxygen/nitrogen-heterocyclic compound thereof | 中国科学院天津工业生物技术研究所 | 2024-11-12 | — | — | CN | disclosed |
| CN-116240194-A | Limonene epoxy hydrolase mutant and catalytic synthesis of chiral oxygen/nitrogen-heterocyclic compound thereof | 中国科学院天津工业生物技术研究所 | 2023-06-09 | — | — | CN | disclosed |