Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | NMT2 | O60551 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3912017 | 1.00 | REN (0.37) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3902420 | 0.94 | REN (0.38) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL5069719 | 0.94 | REN (0.38) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3945248 | 0.92 | REN (0.37) | REN | |
| SCHEMBL1035197 | 0.92 | REN (0.38) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL1039229 | 0.91 | REN (0.38) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL1038319 | 0.91 | MMP9 (0.35) | RENTHRBTP53 | |
| SCHEMBL1039582 | 0.91 | THRB (0.36) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL3910212 | 0.91 | THRB (0.35) | RENTHRBCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL1038926 | 0.91 | REN (0.35) | RENTHRBCYP3A4CYP2C19ALDH1A1 |
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-2049514-B1 | NITRATE ESTERS OF PIPERIDINES | NOVARTIS AG (CH) | 2011-01-26 | — | — | EP | disclosed |