Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 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 | |
|---|---|---|---|---|
| SCHEMBL5576688 | 0.80 | EPHX2 (0.49) | EPHX2KCNH2ALDH1A1MAPK1MEN1 | |
| SCHEMBL5763199 | 0.79 | GABRA1 (0.37) | EPHX2GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL1161006 | 0.77 | EPHX2 (0.38) | EPHX2KCNH2ALDH1A1HPGDMAPK1 | |
| SCHEMBL7364773 | 0.76 | EPHX2 (0.33) | EPHX2MAPK1 | |
| SCHEMBL4586631 | 0.76 | EPHX2 (0.37) | EPHX2KCNH2MAPK1SMN1; SMN2MEN1 | |
| SCHEMBL3986151 | 0.76 | EPHX2 (0.37) | EPHX2KCNH2MEN1KMT2A | |
| SCHEMBL27824398 | 0.74 | EPHX2 (0.36) | EPHX2KCNH2MAPK1PPARG | |
| SCHEMBL19586307 | 0.74 | CA12 (0.42) | EPHX2ALDH1A1MEN1KMT2A | |
| SCHEMBL6810224 | 0.72 | AR (0.41) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL7356234 | 0.71 | EPHX2 (0.30) | EPHX2 |
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-1112269-A2 | HIV PROTEASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000015634-A2 | HIV PROTEASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2000-03-23 | — | — | WO | disclosed |