Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.56 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.48 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5717032 | 1.00 | EPHX2 (0.56) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5717024 | 0.86 | HCRTR1 (0.64) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5717146 | 0.86 | EPHX2 (0.52) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5717147 | 0.86 | EPHX2 (0.52) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5717267 | 0.84 | ALDH1A1 (0.55) | EPHX2HCRTR1HCRTR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL15010114 | 0.82 | HCRTR1 (0.68) | HCRTR1HCRTR2ALDH1A1HTTBRD4 | |
| SCHEMBL15010113 | 0.82 | HCRTR1 (0.68) | HCRTR1HCRTR2ALDH1A1HTTBRD4 | |
| SCHEMBL5716988 | 0.80 | ALDH1A1 (0.66) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5716989 | 0.80 | ALDH1A1 (0.66) | EPHX2HCRTR1HCRTR2ALDH1A1HTT | |
| SCHEMBL5717022 | 0.80 | ALDH1A1 (0.66) | EPHX2HCRTR1HCRTR2ALDH1A1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1664010-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | Vernalis (R&D) Limited (GB) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005068448-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-07-28 | — | — | WO | disclosed |