Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.32 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.32 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.32 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.32 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.32 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.32 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29017365 | 1.00 | P2RX7 (0.40) | P2RX7HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL1121055 | 0.89 | P2RX7 (0.44) | P2RX7HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL12988537 | 0.87 | PRKAB2 (0.38) | P2RX7HDAC3HDAC1HDAC7HDAC2 | |
| SCHEMBL29017400 | 0.83 | OPRM1 (0.45) | P2RX7ALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL29017330 | 0.83 | SLC6A3 (0.42) | P2RX7LMNAOPRM1 | |
| SCHEMBL29017376 | 0.83 | P2RX7 (0.47) | P2RX7ALDH1A1PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL29017358 | 0.83 | OPRM1 (0.45) | P2RX7ALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL29017386 | 0.83 | SLC6A3 (0.42) | P2RX7LMNAOPRM1 | |
| SCHEMBL29017380 | 0.83 | P2RX7 (0.47) | P2RX7ALDH1A1PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL29017375 | 0.82 | MAOA (0.42) | ALDH1A1MAPK1L3MBTL1TAAR1 |
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 |