Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | RXRA | P19793 | 3/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | POLQ | O75417 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.33 |
| ▸ | DDR1 | Q08345 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12366413 | 0.91 | NR1H2 (0.36) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366303 | 0.90 | NR1H2 (0.40) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366427 | 0.90 | ALDH1A1 (0.51) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366218 | 0.89 | ALDH1A1 (0.41) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366320 | 0.85 | KDM4E (0.47) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366315 | 0.84 | ALDH1A1 (0.48) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366437 | 0.84 | RXRA (0.38) | ALDH1A1RXRANR1H2NR1H3CNR1 | |
| SCHEMBL12366432 | 0.84 | RXRA (0.38) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366459 | 0.83 | KDM4E (0.43) | KDM4EALDH1A1RXRANR1H2NR1H3 | |
| SCHEMBL12366818 | 0.83 | NR1H2 (0.49) | KDM4EALDH1A1RXRANR1H2NR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |