Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6410889 | 0.86 | MAPT (0.39) | ALDH1A1EPHX2MAPTTP53NPC1 | |
| SCHEMBL15309174 | 0.85 | ALDH1A1 (0.44) | ALDH1A1MAPTTP53NPC1POLB | |
| SCHEMBL2583086 | 0.78 | CYP2C19 (0.44) | ALDH1A1EPHX2MAPTPOLBLMNA | |
| SCHEMBL6848466 | 0.77 | KDM4E (0.41) | ALDH1A1EPHX2MAPTNPC1POLB | |
| SCHEMBL2401204 | 0.74 | LMNA (0.46) | ALDH1A1MAPTTP53NPC1POLB | |
| SCHEMBL3510744 | 0.73 | ALDH1A1 (0.50) | ALDH1A1EPHX2MAPTTP53NPC1 | |
| SCHEMBL2399960 | 0.73 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBL3MBTL1LMNA | |
| SCHEMBL2400381 | 0.73 | EPHX2 (0.51) | EPHX2MAPTNPC1CTDSP1TDP1 | |
| SCHEMBL3427781 | 0.71 | MAPT (0.72) | ALDH1A1MAPTTP53NPC1POLB | |
| SCHEMBL2402512 | 0.71 | EPHX2 (0.49) | ALDH1A1EPHX2MAPTCTDSP1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8048890-B2 | Analgesics; neuropathic pain; headaches; muscle relaxants; incontence; tinnitus; diarrhea; antiarrhythmia agents; antiischemic agents; antiinflammatory agents; antiulcer agents; antidepressants; antiepileptic agents | GRUENENTHAL GMBH (DE) | 2011-11-01 | — | — | US | claimed |
| EP-1401841-B1 | SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN | GRUENENTHAL GMBH (DE) | 2005-08-24 | — | — | EP | claimed |