Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 13/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 12/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.37 |
| ▸ | TSHR | P16473 | 8/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20219660 | 0.86 | TLR7 (0.49) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL23472391 | 0.83 | SLC2A1 (0.41) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL23472238 | 0.81 | TLR7 (0.43) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL20219500 | 0.80 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL23472249 | 0.79 | PDE5A (0.40) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL23472382 | 0.79 | TLR8 (0.43) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL20219358 | 0.78 | CYP3A4 (0.41) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL20219267 | 0.76 | TLR7 (0.44) | CYP1A2CYP3A4CYP2C19LMNAALDH1A1 | |
| SCHEMBL23472141 | 0.76 | SMN1; SMN2 (0.50) | LMNATSHRMAPK1HSD17B10KDM4E | |
| SCHEMBL20219757 | 0.76 | TLR7 (0.39) | CYP1A2CYP3A4TLR7TLR8KDM4E |
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-3590928-B1 | PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) | 2021-06-09 | — | — | EP | disclosed |