Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29757390 | 0.84 | ROCK2 (0.46) | ROCK2ROCK1ALDH1A1 | |
| SCHEMBL20899151 | 0.76 | FLT1 (0.52) | SMN1; SMN2KMT2AGAAMAPTKDM4E | |
| SCHEMBL17109521 | 0.76 | MEN1 (0.47) | MAPK1KMT2AGAAMAPTALDH1A1 | |
| SCHEMBL20898458 | 0.74 | NPSR1 (0.48) | MAPK1CYP3A4ALOX15KMT2AGAA | |
| SCHEMBL29757380 | 0.72 | EPHB3 (0.37) | SMN1; SMN2MAPK1KMT2AGAAMAPT | |
| SCHEMBL29757379 | 0.72 | EPHB3 (0.37) | SMN1; SMN2MAPK1KMT2AGAAMAPT | |
| SCHEMBL29757381 | 0.72 | PDE2A (0.41) | SMN1; SMN2MAPTHTT | |
| SCHEMBL15524658 | 0.71 | MAPT (0.45) | SMN1; SMN2MAPK1CYP3A4ALOX15KMT2A | |
| SCHEMBL21162020 | 0.70 | MAPK1 (0.47) | SMN1; SMN2MAPK1CYP3A4KMT2AGAA | |
| SCHEMBL6026801 | 0.69 | SMN1; SMN2 (0.58) | SMN1; SMN2MAPK1CYP3A4ALOX15PPARG |
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 |
|---|---|---|---|---|---|---|---|
| CN-114702488-A | Fused-ring amide compound, and pharmaceutical composition, preparation method and application thereof | 中以海德人工智能药物研发股份有限公司 | 2022-07-05 | — | — | CN | disclosed |