Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 8/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | PHGDH | O43175 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL7800872 | 1.00 | PRCP (0.41) | PRCPKCNH2HSP90AA1NTSR1AKR1C3 | |
| Hydrochloric Acid SCHEMBL8989823 | 0.99 | PRCP (0.41) | PRCPKCNH2HSP90AA1NTSR1AKR1C3 | |
| Hydrochloric Acid SCHEMBL7793165 | 0.99 | PRCP (0.41) | PRCPKCNH2HSP90AA1NTSR1AKR1C3 | |
| Hydrochloric Acid SCHEMBL8989822 | 0.99 | PRCP (0.41) | PRCPKCNH2HSP90AA1NTSR1AKR1C3 | |
| Hydrochloric Acid SCHEMBL7793169 | 0.99 | PRCP (0.41) | PRCPKCNH2HSP90AA1NTSR1AKR1C3 | |
| SCHEMBL7799095 | 0.88 | CYP3A4 (0.47) | PRCPKCNH2CYP3A4CYP2C19 | |
| SCHEMBL7799097 | 0.88 | CYP3A4 (0.47) | PRCPKCNH2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL7803102 | 0.87 | CYP3A4 (0.46) | PRCPKCNH2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL7803100 | 0.87 | CYP3A4 (0.46) | PRCPKCNH2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL8989801 | 0.87 | CYP3A4 (0.46) | PRCPKCNH2CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0720605-B1 | AMINOCYCLOHEXYLESTERS AND USES THEREOF | UNIV BRITISH COLUMBIA (CA) | 2001-12-19 | — | — | EP | claimed |