Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 15/20 | 0.50 |
| ▸ | NR1H3 | Q13133 | 14/20 | 0.50 |
| ▸ | RXRA | P19793 | 10/20 | 0.50 |
| ▸ | RORA | P35398 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | RORB | Q92753 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.32 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.32 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3475143 | 0.88 | NR1H2 (0.64) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL4631573 | 0.86 | NR1H2 (0.51) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3474314 | 0.81 | NR1H2 (0.68) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3472735 | 0.80 | NR1H2 (0.66) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3470705 | 0.78 | NR1H2 (0.65) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3472912 | 0.77 | NR1H2 (0.64) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3475867 | 0.76 | NR1H2 (0.65) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3472810 | 0.75 | NR1H2 (0.66) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3473930 | 0.75 | NR1H2 (0.70) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3472603 | 0.75 | NR1H2 (0.68) | NR1H2NR1H3RXRARORARORC |
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-1910307-A1 | PYRAZOLE BASED LXR MODULATORS | Exelixis, Inc. (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007002559-A1 | PYRAZOLE BASED LXR MODULATORS | EXELIXIS, INC. (US) | 2007-01-04 | — | — | WO | disclosed |