Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PRCP | P42785 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7798816 | 1.00 | SMN1; SMN2 (0.43) | SMN1; SMN2KEAP1NFE2L2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL7793154 | 0.99 | SMN1; SMN2 (0.43) | SMN1; SMN2KEAP1NFE2L2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL7793156 | 0.99 | SMN1; SMN2 (0.43) | SMN1; SMN2KEAP1NFE2L2CYP3A4CYP2C19 | |
| SCHEMBL7802109 | 0.72 | KCNA5 (0.44) | SMN1; SMN2MEN1KMT2AALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL7799076 | 0.71 | KCNA5 (0.43) | SMN1; SMN2MEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL13785559 | 0.70 | KEAP1 (0.65) | KEAP1NFE2L2CYP3A4OPRM1ALDH1A1 | |
| SCHEMBL11493161 | 0.70 | L3MBTL1 (0.49) | SMN1; SMN2CYP3A4CYP2C19OPRM1ATM | |
| SCHEMBL7799095 | 0.69 | CYP3A4 (0.47) | SMN1; SMN2CYP3A4CYP2C19SLC18A3ALDH1A1 | |
| SCHEMBL7799097 | 0.69 | CYP3A4 (0.47) | SMN1; SMN2CYP3A4CYP2C19SLC18A3ALDH1A1 | |
| SCHEMBL7800907 | 0.69 | MEN1 (0.44) | SMN1; SMN2KEAP1NFE2L2CYP3A4CYP2C19 |
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 |