Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6417720 | 0.90 | ALDH1A1 (0.58) | CYP2C19KMT2AALDH1A1MEN1L3MBTL1 | |
| SCHEMBL6410962 | 0.89 | PKM (0.50) | KMT2AALDH1A1MEN1L3MBTL1PKM | |
| SCHEMBL6410302 | 0.89 | SMN1; SMN2 (0.58) | KMT2AALDH1A1MEN1L3MBTL1MAPK1 | |
| SCHEMBL6410874 | 0.89 | PKM (0.46) | KMT2AALDH1A1MEN1L3MBTL1MAPK1 | |
| SCHEMBL6409410 | 0.86 | FAAH (0.48) | KMT2AALDH1A1MEN1L3MBTL1MAPK1 | |
| SCHEMBL6412295 | 0.84 | MEN1 (0.52) | KMT2AALDH1A1MEN1L3MBTL1MAPK1 | |
| SCHEMBL6409429 | 0.83 | LMNA (0.41) | CYP2C19KMT2AALDH1A1L3MBTL1SMN1; SMN2 | |
| SCHEMBL6410504 | 0.83 | MEN1 (0.49) | KMT2AALDH1A1MEN1L3MBTL1MAPK1 | |
| SCHEMBL6416697 | 0.83 | CYP2C19 (0.52) | CYP2C19KMT2AALDH1A1MEN1L3MBTL1 | |
| SCHEMBL6411481 | 0.82 | POLB (0.44) | CYP2C19KMT2AALDH1A1MEN1PKM |
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-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 | disclosed |