Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOD1 | P00441 | 1/20 | 0.65 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.30 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL18290200 | 0.82 | SOD1 (0.76) | SOD1KARS1CYP19A1CYP3A4MAPT | |
| SCHEMBL30712349 | 0.82 | SOD1 (0.49) | SOD1KARS1CYP3A4MAPTALOX15 | |
| SCHEMBL18290292 | 0.79 | SOD1 (1.00) | SOD1KARS1CYP3A4MAPTALOX15 | |
| SCHEMBL18290208 | 0.79 | SOD1 (1.00) | SOD1KARS1CYP3A4MAPTALOX15 | |
| SCHEMBL29553306 | 0.71 | KARS1 (0.64) | KARS1CYP3A4MAPTTP53CYP2C9 | |
| Sugiol SCHEMBL17407685 | 0.69 | SOD1 (0.58) | SOD1KARS1CYP19A1CYP3A4MAPT | |
| Sugiol SCHEMBL28605319 | 0.69 | SOD1 (0.58) | SOD1KARS1CYP19A1CYP3A4MAPT | |
| Sugiol SCHEMBL1086916 | 0.69 | SOD1 (0.58) | SOD1KARS1CYP19A1CYP3A4MAPT | |
| Hypargenin C SCHEMBL18290364 | 0.67 | SOD1 (0.55) | SOD1KARS1CYP19A1CYP3A4MAPT | |
| Hypargenin C SCHEMBL13532268 | 0.67 | SOD1 (0.55) | SOD1KARS1CYP19A1CYP3A4MAPT |
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-2016192631-A1 | ABIETANE-TYPE DITERPENE COMPOUND HAVING LIPID-LOWERING ACTIVITY, METHOD FOR PREPARING SAME, AND USE OF SAME | 中国科学院上海药物研究所 | 2016-12-08 | — | — | WO | disclosed |