Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SCD | O00767 | 1/20 | 0.37 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAPGEF3 | O95398 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10148017 | 0.81 | CNR2 (0.36) | ALDH1A1MAPK1SMN1; SMN2MAPK14GAA | |
| SCHEMBL352560 | 0.79 | CNR2 (0.56) | ALDH1A1MAPK1SMN1; SMN2MAPK14GAA | |
| SCHEMBL13618735 | 0.78 | ALDH1A1 (0.51) | ALDH1A1MAPK1SMN1; SMN2MAPK14GAA | |
| SCHEMBL13393043 | 0.71 | MAPK14 (0.48) | ALDH1A1SMN1; SMN2MAPK14NPC1RAB9A | |
| SCHEMBL12095580 | 0.70 | RAB9A (0.52) | SMN1; SMN2MAPK14NPC1RAB9APKM | |
| SCHEMBL10147498 | 0.68 | ALDH1A1 (0.42) | ALDH1A1MAPK1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL26795644 | 0.68 | ALDH1A1 (0.57) | ALDH1A1MAPK1SMN1; SMN2MAPK14NPC1 | |
| SCHEMBL11134573 | 0.66 | ALDH1A1 (0.60) | ALDH1A1MAPK1SMN1; SMN2MAPK14NPC1 | |
| SCHEMBL18407332 | 0.66 | ALDH1A1 (0.56) | ALDH1A1MAPK1SMN1; SMN2MAPK14NPC1 | |
| SCHEMBL12824585 | 0.64 | SLC22A12 (0.51) | ALDH1A1HTTMEN1KMT2A |
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-2418207-A1 | Sulfone compounds which modulate the CB2 receptor | Boehringer Ingelheim International GmbH (DE) | 2012-02-15 | — | — | EP | disclosed |