Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.38 |
| ▸ | SRC | P12931 | 3/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1712493 | 0.98 | NR1H4 (0.51) | NR1H4PTGS2SRCENPP2GABRA1 | |
| SCHEMBL2381928 | 0.81 | NR1H4 (0.59) | NR1H4PTGS2SRCENPP2GABRA1 | |
| SCHEMBL1712723 | 0.80 | NR1H4 (0.53) | NR1H4PTGS2ENPP2GABRA1GABRA2 | |
| SCHEMBL2382733 | 0.80 | NR1H4 (0.62) | NR1H4PTGS2SRCENPP2GABRA1 | |
| SCHEMBL1712067 | 0.79 | NR1H4 (0.54) | NR1H4PTGS2ENPP2GABRA1GABRA2 | |
| SCHEMBL2383338 | 0.79 | NR1H4 (0.54) | NR1H4PTGS2ENPP2GABRA1GABRA2 | |
| SCHEMBL2381422 | 0.79 | NR1H4 (0.57) | NR1H4PTGS2ENPP2GABRA1GABRA2 | |
| SCHEMBL1712371 | 0.79 | NR1H4 (0.57) | NR1H4PTGS2ENPP2GABRA1GABRA2 | |
| SCHEMBL1712621 | 0.79 | NR1H4 (0.55) | NR1H4PTGS2ENPP2CNR1CNR2 | |
| SCHEMBL1712617 | 0.79 | NR1H4 (0.55) | NR1H4PTGS2ENPP2CNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011117163-A1 | CYCLOPENTYL - AND CYCLOHEPTYLPYRAZOLES AS FXR MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-09-29 | — | — | WO | disclosed |