Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 13/20 | 0.54 |
| ▸ | PPARD | Q03181 | 6/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CCNK | O75909 | 1/20 | 0.33 |
| ▸ | CCND3 | P30281 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CDK7 | P50613 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | CCNH | P51946 | 1/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.33 |
| ▸ | CDK12 | Q9NYV4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3149728 | 0.92 | NR1H4 (0.52) | NR1H4PPARD | |
| SCHEMBL3150227 | 0.84 | NR1H4 (0.59) | NR1H4MRGPRX4 | |
| SCHEMBL498139 | 0.82 | NR1H4 (0.57) | NR1H4MRGPRX4KMT2ACCNKCCND3 | |
| SCHEMBL3165066 | 0.81 | NR1H4 (0.51) | NR1H4PPARDMRGPRX4KMT2A | |
| SCHEMBL3165073 | 0.81 | NR1H4 (0.51) | NR1H4PPARDMRGPRX4KMT2A | |
| SCHEMBL497577 | 0.79 | NR1H4 (0.60) | NR1H4MRGPRX4KMT2ACCNKCCND3 | |
| SCHEMBL3150710 | 0.79 | NR1H4 (0.53) | NR1H4PPARDMRGPRX4KMT2ACCNK | |
| SCHEMBL3150714 | 0.79 | NR1H4 (0.51) | NR1H4PPARDKMT2ACCNKCCND3 | |
| SCHEMBL3157598 | 0.78 | NR1H4 (0.52) | NR1H4PPARDMRGPRX4 | |
| SCHEMBL3157584 | 0.77 | NR1H4 (0.53) | NR1H4PPARDMRGPRX4CCNKCCND3 |
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 |