Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | UBE2M | P61081 | 1/20 | 0.39 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.39 |
| ▸ | GCGR | P47871 | 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 | |
|---|---|---|---|---|
| SCHEMBL7210327 | 1.00 | HPGD (0.42) | HPGDALDH1A1SPHK1RAB9ANPC1 | |
| SCHEMBL4807152 | 0.91 | LSS (0.46) | HPGDALDH1A1SPHK1RAB9ANPC1 | |
| SCHEMBL4807162 | 0.91 | LSS (0.46) | HPGDALDH1A1SPHK1RAB9ANPC1 | |
| SCHEMBL4809020 | 0.90 | LSS (0.47) | HPGDALDH1A1SPHK1RAB9ANPC1 | |
| SCHEMBL4809026 | 0.90 | LSS (0.47) | HPGDALDH1A1SPHK1RAB9ANPC1 | |
| SCHEMBL7212235 | 0.90 | ATM (0.40) | ALDH1A1RAB9AATMUBE2MDCUN1D1 | |
| SCHEMBL7212232 | 0.90 | ATM (0.40) | ALDH1A1RAB9AATMUBE2MDCUN1D1 | |
| SCHEMBL7208465 | 0.89 | LSS (0.47) | RAB9APPARGPPARDPPARAATM | |
| SCHEMBL7208470 | 0.89 | LSS (0.47) | RAB9APPARGPPARDPPARAATM | |
| SCHEMBL7206024 | 0.88 | LSS (0.48) | RAB9APPARGPPARDPPARAATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |