Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL8153607 | 0.94 | CYP1A2 (0.32) | ALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL5988353 | 0.72 | DPP4 (0.39) | ALDH1A1EPHX2EPHX1 | |
| SCHEMBL1605302 | 0.69 | EPHX2 (0.41) | EPHX2EPHX1 | |
| SCHEMBL3068271 | 0.68 | PKM (0.53) | ALDH1A1CYP3A4CYP2C19PKML3MBTL1 | |
| SCHEMBL3071718 | 0.66 | EPHX2 (0.43) | EPHX2EPHX1 | |
| SCHEMBL3068816 | 0.66 | EPHX2 (0.60) | ALDH1A1L3MBTL1EPHX2EPHX1 | |
| SCHEMBL9011407 | 0.63 | EPHX2 (0.40) | ALDH1A1EPHX2EPHX1 | |
| SCHEMBL26289682 | 0.63 | EPHX1 (0.39) | ALDH1A1EPHX2EPHX1 | |
| SCHEMBL8042539 | 0.63 | EPHX2 (0.45) | ALDH1A1EPHX2EPHX1 | |
| SCHEMBL5994123 | 0.63 | ALDH1A1 (0.50) | ALDH1A1EPHX2EPHX1 |
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-1028961-A1 | PLEUROMUTILIN DERIVATIVES AS ANTIMICROBIALS | SMITHKLINE BEECHAM PLC (GB) | 2000-08-23 | — | — | EP | disclosed |
| WO-1999021855-A1 | PLEUROMUTILIN DERIVATIVES AS ANTIMICROBIALS | SMITHKLINE BEECHAM P.L.C. (GB) | 1999-05-06 | — | — | WO | disclosed |