Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 3/20 | 0.32 |
| ▸ | KIT | P10721 | 3/20 | 0.32 |
| ▸ | SRC | P12931 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.32 |
| ▸ | COMT | P21964 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.31 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24017805 | 0.85 | HCAR1 (0.42) | NOS3NOS1NOS2LCKKIT | |
| SCHEMBL22386367 | 0.79 | ALDH1A1 (0.42) | ROCK2LCKKITSRCSMN1; SMN2 | |
| SCHEMBL22995728 | 0.79 | XDH (0.42) | ROCK2ADORA2ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL22233947 | 0.79 | NPC1 (0.43) | ROCK2LCKKITSRCKDR | |
| SCHEMBL20019313 | 0.79 | MAT2A (0.39) | LCKKITSRCSMN1; SMN2LMNA | |
| SCHEMBL23678820 | 0.78 | LCK (0.34) | ROCK2NOS3NOS1NOS2LCK | |
| SCHEMBL22386326 | 0.75 | ROCK2 (0.39) | ROCK2LCKSMN1; SMN2FGFR1LMNA | |
| SCHEMBL2113288 | 0.75 | SMN1; SMN2 (0.52) | LCKKITSRCCOMTSMN1; SMN2 | |
| SCHEMBL22870491 | 0.75 | XDH (0.40) | NOS3NOS1NOS2COMT | |
| SCHEMBL24285423 | 0.74 | ELANE (0.41) | ROCK2NOS3NOS2LCKKIT |
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-3239134-B1 | PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS | VERTEX PHARMA (US) | 2020-12-23 | — | — | EP | disclosed |