Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.73 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GRM6 | O15303 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14631965 | 0.89 | ALOX5 (0.57) | ALOX5NTRK1PTGS1PTGS2SMN1; SMN2 | |
| SCHEMBL27824201 | 0.88 | ALOX5 (0.56) | ALOX5SMN1; SMN2KDM4EMEN1MAPT | |
| SCHEMBL28786380 | 0.85 | ALOX5 (0.54) | ALOX5PTGS1PTGS2ALDH1A1GRM6 | |
| SCHEMBL27837187 | 0.85 | ALOX5 (0.54) | ALOX5PTGS1PTGS2SMN1; SMN2ALDH1A1 | |
| SCHEMBL9629544 | 0.84 | ALOX5 (1.00) | ALOX5SMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL27803410 | 0.84 | ALOX5 (0.73) | ALOX5PTGS1PTGS2SMN1; SMN2ALDH1A1 | |
| SCHEMBL28790234 | 0.83 | ALOX5 (0.52) | ALOX5PTGS2SMN1; SMN2MAPTKMT2A | |
| SCHEMBL27899608 | 0.83 | ALOX5 (0.52) | ALOX5PTGS2GAA | |
| SCHEMBL27626587 | 0.83 | ALOX5 (0.71) | ALOX5SMN1; SMN2ALDH1A1KDM4EHPGD | |
| SCHEMBL27817785 | 0.82 | ALOX5 (0.55) | ALOX5SMN1; SMN2ALDH1A1HPGDFFAR4 |
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 |