Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4958115 | 0.95 | REN (0.35) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL2917973 | 0.92 | TMEM97 (0.35) | RENALDH1A1 | |
| SCHEMBL5503959 | 0.89 | REN (0.36) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL5507277 | 0.88 | REN (0.36) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3555798 | 0.87 | ALDH1A1 (0.33) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL2925215 | 0.87 | TP53 (0.37) | RENTHRBALDH1A1 | |
| SCHEMBL2923347 | 0.87 | LMNA (0.36) | ALDH1A1MAPTLMNA | |
| SCHEMBL3903011 | 0.86 | REN (0.36) | REN | |
| SCHEMBL2922840 | 0.86 | TMEM97 (0.35) | RENALDH1A1 | |
| SCHEMBL2917780 | 0.86 | TP53 (0.34) | RENALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1958634-A2 | Substituted piperidines as inhibitors of beta-secretase, cathepsin D, plasmepsin II and/or HIV protease | Speedel Experimenta AG (CH) | 2008-08-20 | — | — | EP | disclosed |