Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CHIT1 | Q13231 | 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 | |
|---|---|---|---|---|
| SCHEMBL4665533 | 0.83 | TRPA1 (0.38) | TRPA1OPRM1OPRL1SLC6A4SLC6A3 | |
| SCHEMBL4665899 | 0.79 | CXCR4 (0.36) | TRPA1OPRM1OPRL1SLC6A4SLC6A3 | |
| SCHEMBL4665552 | 0.79 | STS (0.43) | TRPA1HSD11B1CCR5 | |
| SCHEMBL4665942 | 0.75 | SMN1; SMN2 (0.38) | TRPA1OPRM1SMN1; SMN2SLC6A4SLC6A3 | |
| SCHEMBL4664121 | 0.73 | SLC6A4 (0.38) | TRPA1OPRM1OPRL1SMN1; SMN2SLC6A4 | |
| SCHEMBL29693296 | 0.71 | ALDH1A1 (0.43) | TRPA1CCR5POLB | |
| SCHEMBL25838949 | 0.70 | ALDH1A1 (0.54) | SMN1; SMN2SLC6A4SLC6A3NPC1RAB9A | |
| SCHEMBL4663513 | 0.67 | SLC6A4 (0.36) | TRPA1OPRM1OPRL1SMN1; SMN2SLC6A4 | |
| SCHEMBL4664004 | 0.65 | SLC6A4 (0.37) | TRPA1OPRM1OPRL1SMN1; SMN2SLC6A4 | |
| SCHEMBL4665379 | 0.64 | OPRK1 (0.42) | OPRM1SMN1; SMN2SLC6A4SLC6A3SLC6A2 |
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-1571140-B1 | C-substituted cyclohexylmethylamine derivatives | GRUENENTHAL GMBH (DE) | 2008-11-12 | — | — | EP | claimed |