Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2920660 | 1.00 | REN (0.36) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2925073 | 0.92 | REN (0.36) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2925028 | 0.92 | REN (0.36) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2919377 | 0.91 | REN (0.37) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL3557355 | 0.90 | REN (0.35) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2919180 | 0.90 | REN (0.35) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL3558905 | 0.90 | REN (0.37) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2925318 | 0.90 | REN (0.37) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL8471181 | 0.90 | REN (0.37) | RENALDH1A1THRBCYP3A4CYP2D6 | |
| SCHEMBL2924802 | 0.88 | TSHR (0.40) | RENTHRBCYP3A4CYP2D6CYP2C19 |
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 |