Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SLC29A1 | Q99808 | 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 | |
|---|---|---|---|---|
| SCHEMBL13785559 | 0.70 | KEAP1 (0.65) | KEAP1NFE2L2ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL28174993 | 0.70 | SMN1; SMN2 (0.51) | SMN1; SMN2ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL13865471 | 0.70 | KEAP1 (0.54) | KEAP1NFE2L2ALDH1A1CHRM3CHRM2 | |
| SCHEMBL4475515 | 0.70 | KEAP1 (0.54) | KMT2AKEAP1NFE2L2CHRM3CHRM2 | |
| SCHEMBL7798816 | 0.69 | SMN1; SMN2 (0.43) | MEN1KMT2ASMN1; SMN2KEAP1NFE2L2 | |
| SCHEMBL7798819 | 0.69 | SMN1; SMN2 (0.43) | MEN1KMT2ASMN1; SMN2KEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL7793154 | 0.68 | SMN1; SMN2 (0.43) | MEN1KMT2ASMN1; SMN2KEAP1NFE2L2 | |
| Hydrochloric Acid SCHEMBL7793156 | 0.68 | SMN1; SMN2 (0.43) | MEN1KMT2ASMN1; SMN2KEAP1NFE2L2 | |
| SCHEMBL13785558 | 0.68 | KEAP1 (0.56) | KEAP1NFE2L2ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL5161565 | 0.67 | CHRM3 (0.49) | ALDH1A1CHRM3CHRM2CHRM1 |
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 |