Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 11/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 11/20 | 0.44 |
| ▸ | RXRA | P19793 | 9/20 | 0.44 |
| ▸ | RORA | P35398 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | RORB | Q92753 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15641675 | 0.89 | NR1H2 (0.51) | NR1H2NR1H3RXRALOXL2KCNH2 | |
| SCHEMBL3471809 | 0.82 | RXRA (0.43) | NR1H2NR1H3RXRA | |
| SCHEMBL3472473 | 0.80 | NR1H2 (0.55) | NR1H2NR1H3RXRALOXL2KCNH2 | |
| SCHEMBL3472214 | 0.79 | NR1H2 (0.51) | NR1H2NR1H3RXRAPIK3CAHSD17B1 | |
| SCHEMBL3472604 | 0.79 | NR1H2 (0.70) | NR1H2NR1H3RXRALOXL2KCNH2 | |
| SCHEMBL3473610 | 0.77 | NR1H2 (0.64) | NR1H2NR1H3RXRAPIK3CAHSD17B1 | |
| SCHEMBL3474365 | 0.75 | NR1H2 (0.59) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3472959 | 0.75 | NR1H2 (0.57) | NR1H2NR1H3RXRARORARORC | |
| SCHEMBL3474961 | 0.74 | NR1H2 (0.54) | NR1H2NR1H3RXRALOXL2PIK3CA | |
| SCHEMBL3470903 | 0.74 | NR1H2 (0.44) | NR1H2NR1H3RXRALOXL2KCNH2 |
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 |