Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL17029137 | 0.79 | NLRP3 (0.43) | NLRP3CYP3A4CYP2C19ALDH1A1LMNA | |
| SCHEMBL28208217 | 0.73 | ALDH1A1 (0.46) | NLRP3CYP3A4CYP2C19ALDH1A1LMNA | |
| SCHEMBL15128324 | 0.70 | ALDH1A1 (0.38) | NLRP3CYP3A4ALDH1A1LMNAHSD17B10 | |
| SCHEMBL8816181 | 0.69 | CHRM2 (0.35) | — | |
| SCHEMBL22640468 | 0.69 | MEN1 (0.32) | — | |
| SCHEMBL1703554 | 0.69 | ALDH1A1 (0.37) | ALDH1A1LMNAHSD17B10 | |
| SCHEMBL27917349 | 0.69 | — | — | |
| SCHEMBL22814668 | 0.69 | — | — | |
| SCHEMBL24912279 | 0.68 | ALDH1A1 (0.43) | NLRP3ALDH1A1LMNAHSD17B10 | |
| SCHEMBL17550206 | 0.68 | ALDH1A1 (0.43) | NLRP3ALDH1A1LMNAHSD17B10 |
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-1747222-B1 | PYRIMIDINE DERIVATIVES ANTAGONISTS OF VITRONECTIN RECEPTOR | GALAPAGOS NV (BE) | 2014-04-16 | — | — | EP | disclosed |