Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 8/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | STS | P08842 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4663574 | 0.76 | TRPA1 (0.40) | TRPA1KCNH2CHIT1SLC6A4SLC6A3 | |
| SCHEMBL4667249 | 0.75 | TRPA1 (0.38) | TRPA1KCNH2CHIT1 | |
| SCHEMBL4667285 | 0.73 | TRPA1 (0.35) | TRPA1KCNH2CHIT1 | |
| SCHEMBL4665899 | 0.64 | CXCR4 (0.36) | TRPA1SLC6A4SLC6A3 | |
| SCHEMBL4663652 | 0.62 | SLC6A2 (0.34) | P2RX7KCNH2TDP1SLC6A4 | |
| Methyl Alcohol SCHEMBL8945240 | 0.62 | TRPA1 (0.48) | TRPA1KCNH2CHIT1SLC6A4SLC6A3 | |
| Methyl Alcohol SCHEMBL8945244 | 0.62 | TRPA1 (0.48) | TRPA1KCNH2CHIT1SLC6A4SLC6A3 | |
| Methyl Alcohol SCHEMBL8945235 | 0.62 | TRPA1 (0.48) | TRPA1KCNH2CHIT1SLC6A4SLC6A3 | |
| SCHEMBL4665552 | 0.60 | STS (0.43) | TRPA1KDM4EL3MBTL1STS | |
| SCHEMBL1826118 | 0.59 | AKT2 (0.51) | SLC6A4SLC6A3 |
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 |