Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 7/20 | 0.54 |
| ▸ | MRGPRX4 | Q96LA9 | 10/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3168928 | 0.93 | NR1H4 (0.53) | NR1H4MRGPRX4 | |
| SCHEMBL3164116 | 0.90 | NR1H4 (0.63) | NR1H4MRGPRX4 | |
| SCHEMBL3164073 | 0.89 | NR1H4 (0.46) | NR1H4MRGPRX4MEN1KMT2A | |
| SCHEMBL3159617 | 0.87 | NR1H4 (0.47) | NR1H4MRGPRX4PPARA | |
| SCHEMBL3168706 | 0.85 | NR1H4 (0.61) | NR1H4MRGPRX4 | |
| SCHEMBL3164369 | 0.82 | NR1H4 (0.60) | NR1H4 | |
| SCHEMBL498196 | 0.82 | NR1H4 (0.48) | NR1H4MRGPRX4 | |
| SCHEMBL3164122 | 0.81 | NR1H4 (0.57) | NR1H4MRGPRX4TYMS | |
| SCHEMBL496925 | 0.79 | NR1H4 (0.53) | NR1H4MRGPRX4MEN1KMT2A | |
| SCHEMBL3168921 | 0.79 | NR1H4 (0.55) | NR1H4MRGPRX4PPARATYMS |
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-2029558-B1 | COMPOUNDS AND METHODS FOR MODULATING FXR | LILLY CO ELI (US) | 2010-03-10 | — | — | EP | disclosed |