Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 2/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.35 |
| ▸ | CTRC | Q99895 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL9250689 | 0.90 | AGTR1 (0.34) | AGTR1AGTR2SMOCTRCPTGS1 | |
| SCHEMBL9250685 | 0.90 | SMO (0.34) | AGTR1AGTR2SMOPTGS1 | |
| SCHEMBL8806788 | 0.89 | AGTR1 (0.42) | AGTR1AGTR2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL1228189 | 0.87 | AGTR1 (0.53) | AGTR1AGTR2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL8808929 | 0.83 | ALDH1A1 (0.41) | AGTR1AGTR2ALDH1A1HPGDHSD17B10 | |
| Acetic Acid SCHEMBL9250323 | 0.79 | DHFR (0.44) | AGTR1AGTR2 | |
| SCHEMBL9250317 | 0.78 | DHFR (0.40) | ALDH1A1 | |
| SCHEMBL9254231 | 0.78 | AGTR1 (0.44) | AGTR1AGTR2CTRC | |
| SCHEMBL8806775 | 0.77 | AGTR1 (0.56) | AGTR1AGTR2 | |
| Acetic Acid SCHEMBL9254240 | 0.76 | AGTR1 (0.45) | AGTR1AGTR2ALDH1A1CTRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0515265-B1 | Pyrimidin derivatives, process for their preparation, the obtained intermediates, their use as medicines and the pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1997-04-16 | — | — | EP | disclosed |
| EP-0515265-A1 | Pyrimidin derivates, process for their preparation, the obtained intermediates, their use as medicines and the pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1992-11-25 | — | — | EP | disclosed |