Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 8/20 | 0.81 |
| ▸ | NR1H3 | Q13133 | 8/20 | 0.81 |
| ▸ | GSK3B | P49841 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4688675 | 0.93 | NR1H2 (0.80) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4450601 | 0.90 | NR1H2 (1.00) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4692898 | 0.85 | NR1H2 (0.81) | NR1H2NR1H3MAPTSMN1; SMN2CASP3 | |
| SCHEMBL4686588 | 0.85 | NR1H2 (0.85) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4691707 | 0.82 | NR1H2 (0.76) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4688601 | 0.81 | NR1H2 (0.78) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4685907 | 0.81 | NR1H2 (1.00) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4690915 | 0.81 | NR1H2 (0.73) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4684030 | 0.80 | NR1H2 (0.80) | NR1H2NR1H3GSK3BMAPTSMN1; SMN2 | |
| SCHEMBL4688066 | 0.80 | NR1H2 (0.80) | NR1H2NR1H3MAPTSMN1; SMN2ALDH1A1 |
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-1646626-B1 | PYRROLE-2, 5-DIONE DERIVATIVES AS LIVER X RECEPTOR MODULATORS | ASTRAZENECA AB (SE) | 2008-07-02 | — | — | EP | claimed |