Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL879890 | 0.82 | ALDH1A1 (0.54) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL16302312 | 0.82 | ALDH1A1 (0.45) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12909149 | 0.70 | ALDH1A1 (0.38) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL3863395 | 0.69 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL16302385 | 0.68 | AR (0.39) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL16104668 | 0.67 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4ETDP1 | |
| SCHEMBL4466255 | 0.67 | ALDH1A1 (0.76) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL16302258 | 0.66 | CA12 (0.42) | ALDH1A1MAPTKDM4ETDP1 | |
| SCHEMBL4466574 | 0.64 | ALDH1A1 (0.56) | ALDH1A1HTTMAPTCYP1A2CYP3A4 | |
| SCHEMBL10476380 | 0.64 | ALDH1A1 (0.56) | ALDH1A1HTTMAPTCYP1A2CYP3A4 |
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-2433940-B9 | SPIROIMIDAZOLONE DERIVATIVE | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2015-10-28 | — | — | EP | disclosed |