Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | UBE2M | P61081 | 1/20 | 0.39 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27817836 | 0.85 | ALOX5 (0.48) | ALOX5ALDH1A1KDM4EHCRTR1HCRTR2 | |
| SCHEMBL27818021 | 0.85 | ALOX5 (0.44) | ALOX5ALDH1A1SMN1; SMN2KMO | |
| SCHEMBL27824189 | 0.85 | ALOX5 (0.64) | ALOX5ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL27824196 | 0.85 | SLC6A3 (0.44) | ALOX5GAAHCRTR1HCRTR2PDE4A | |
| SCHEMBL27899608 | 0.82 | ALOX5 (0.52) | ALOX5TRPM8GAAPTGS2HCRTR1 | |
| SCHEMBL27803393 | 0.82 | ALOX5 (0.52) | ALOX5TRPM8PTGS2KDM4ESMN1; SMN2 | |
| SCHEMBL27817791 | 0.81 | ALOX5 (0.37) | ALOX5ALDH1A1KDM4EHCRTR1HCRTR2 | |
| SCHEMBL27824237 | 0.81 | ALOX5 (0.51) | ALOX5TRPM8ALDH1A1PTGS2KDM4E | |
| SCHEMBL27824038 | 0.79 | ALOX5 (0.49) | ALOX5GAAUBE2MDCUN1D1KDM4E | |
| SCHEMBL983342 | 0.79 | KDM4E (0.46) | TRPM8ALDH1A1GAAGFERUBE2M |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102164896-A | Phenethylamide derivatives and their heterocyclic analogues | ACTELION PHARMACEUTICALS LTD | 2011-08-24 | — | — | CN | disclosed |
| CN-101965343-A | 2-aza-bicyclo[2.2.1]heptane derivatives | ACTELION PHARMACEUTICALS LTD | 2011-02-02 | — | — | CN | disclosed |