Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6409984 | 0.86 | SMN1; SMN2 (0.46) | TP53RAB9ANPC1SMN1; SMN2TNF | |
| SCHEMBL6411644 | 0.85 | L3MBTL1 (0.53) | RAB9ASMN1; SMN2TNFNOD1MAPT | |
| SCHEMBL6414941 | 0.85 | TP53 (0.38) | TP53RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL6410922 | 0.84 | POLB (0.38) | TP53RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL6410874 | 0.83 | PKM (0.46) | SMN1; SMN2MAPK1HTTKDM4EALDH1A1 | |
| SCHEMBL6411653 | 0.82 | ALDH1A1 (0.50) | TP53SMN1; SMN2MAPTMAPK1POLB | |
| SCHEMBL6409449 | 0.79 | CYP2C19 (0.49) | SMN1; SMN2MAPK1HTTPOLBKDM4E | |
| SCHEMBL6417412 | 0.79 | ATM (0.51) | SMN1; SMN2MAPTHTTPOLBATM | |
| SCHEMBL6412249 | 0.79 | JAK2 (0.43) | SMN1; SMN2MAPK1HTTNPSR1ALDH1A1 | |
| SCHEMBL6410504 | 0.78 | MEN1 (0.49) | TP53SMN1; SMN2MAPTMAPK1HTT |
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 |