Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.45 |
| ▸ | SI | P14410 | 1/20 | 0.45 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 10/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PPID | Q08752 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL48439 | 0.92 | GAA (0.52) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL3267070 | 0.85 | PPID (0.52) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL15159445 | 0.85 | GAA (0.48) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL2562528 | 0.83 | GAA (0.52) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL12341372 | 0.83 | EPHX2 (0.56) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL50331 | 0.81 | CYP1A2 (0.53) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL13597739 | 0.81 | GAA (0.48) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL15201482 | 0.80 | GAA (0.52) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL8532591 | 0.80 | EGLN1 (0.50) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL7088568 | 0.78 | GAA (0.54) | GAAMGAMSIMGAM2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012022780-A1 | 18-BETA-GLYCYRRHETINIC ACID DERIVATIVES WITH ANTI-TUMOR ACTIVITY | Université Libre de Bruxelles (BE) | 2012-02-23 | — | — | WO | disclosed |