Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4715224 | 0.89 | ALDH1A1 (0.40) | ALDH1A1KDM4EESR1SMN1; SMN2 | |
| SCHEMBL4714324 | 0.87 | THRA (0.39) | ALDH1A1 | |
| SCHEMBL4710572 | 0.87 | THRA (0.37) | ALDH1A1KDM4EGRM5SMN1; SMN2 | |
| SCHEMBL4715746 | 0.84 | ALDH1A1 (0.44) | ALDH1A1KDM4EGRM5HRH1HTR1B | |
| SCHEMBL4711565 | 0.80 | HTR1B (0.45) | ALDH1A1KDM4EGRM5HRH1HTR1B | |
| SCHEMBL4714453 | 0.73 | ALDH1A1 (0.41) | ALDH1A1KDM4EGRM5SMN1; SMN2 | |
| SCHEMBL4711575 | 0.73 | HRH1 (0.48) | KDM4EHRH1HTR1B | |
| SCHEMBL4712830 | 0.72 | ALDH1A1 (0.39) | ALDH1A1KDM4EGRM5SMN1; SMN2 | |
| SCHEMBL4712903 | 0.72 | HPGD (0.41) | ALDH1A1 | |
| SCHEMBL7349972 | 0.72 | ALDH1A1 (0.46) | ALDH1A1KDM4EHRH1SMN1; SMN2 |
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-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | claimed |