Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4672086 | 0.85 | KCNJ1 (0.53) | SMN1; SMN2ALDH1A1MAPTHTTKCNJ1 | |
| SCHEMBL4675660 | 0.85 | ROCK2 (0.56) | SMN1; SMN2PKMALDH1A1MAPTIDO1 | |
| SCHEMBL4673358 | 0.82 | MAOB (0.46) | SIGMAR1ALDH1A1L3MBTL1 | |
| SCHEMBL4676105 | 0.80 | PKM (0.46) | SMN1; SMN2PKMALDH1A1MAPTHTT | |
| SCHEMBL4670082 | 0.79 | KMT2A (0.48) | SMN1; SMN2PKMALDH1A1MAPTHTT | |
| SCHEMBL4670425 | 0.79 | KMT2A (0.43) | SMN1; SMN2PKMALDH1A1MAPTIDO1 | |
| SCHEMBL4672275 | 0.76 | ALDH1A1 (0.44) | SMN1; SMN2PKMALDH1A1MAPTIDO1 | |
| SCHEMBL4673533 | 0.74 | ENPP2 (0.44) | SMN1; SMN2PKMALDH1A1MAPTHTT | |
| SCHEMBL4673681 | 0.71 | KMT2A (0.54) | SMN1; SMN2PKMALDH1A1MAPTHTT | |
| SCHEMBL4675267 | 0.71 | ALDH1A1 (0.41) | SMN1; SMN2PKMALDH1A1MAPTNPSR1 |
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-1054881-B1 | NOVEL SULFONAMIDE SUBSTITUTED CHROMAN DERIVATIVES USEFUL AS BETA-3 ADRENORECEPTOR AGONISTS | BAYER CORP (US) | 2008-07-30 | — | — | EP | disclosed |