Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.46 |
| ▸ | MELK | Q14680 | 1/20 | 0.45 |
| ▸ | APLNR | P35414 | 1/20 | 0.45 |
| ▸ | DCK | P27707 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2942530 | 0.98 | SLC6A4 (0.45) | APPSLC6A4SLC6A2SLC6A3MELK | |
| SCHEMBL4689684 | 0.92 | HTR2A (0.51) | SLC6A4SLC6A2SLC6A3MELKAPLNR | |
| SCHEMBL2949258 | 0.89 | MELK (0.44) | SLC6A4SLC6A2SLC6A3MELKAPLNR | |
| SCHEMBL2947904 | 0.87 | MELK (0.44) | SLC6A4SLC6A2SLC6A3MELKAPLNR | |
| SCHEMBL4687675 | 0.87 | TUBB4A (0.47) | MELKAPLNRADRA1ATAAR1MAPT | |
| SCHEMBL4684291 | 0.84 | PNLIP (0.42) | MELKAPLNR | |
| SCHEMBL701717 | 0.83 | APLNR (0.47) | MELKAPLNRADRA1ATAAR1GAA | |
| SCHEMBL17593842 | 0.82 | DHFR (0.50) | TSHR | |
| SCHEMBL153750 | 0.82 | APLNR (0.63) | APLNRHTR2AADRA1ATAAR1MAPT | |
| SCHEMBL29350908 | 0.82 | APLNR (0.63) | APLNRHTR2AADRA1ATAAR1MAPT |
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-1805163-B1 | 1,1A,5,5A-TETRAHYDRO-3-THIA-CYCLOPROPA[A]PENTALENES: TRICYCLIC THIOPHENE DERIVATIVES AS S1P1/EDG1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-10-01 | — | — | EP | claimed |