Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 19/20 | 0.47 |
| ▸ | FABP1 | P07148 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22790217 | 0.93 | NR1H4 (0.42) | NR1H4TSHR | |
| SCHEMBL22790212 | 0.90 | NR1H4 (0.44) | NR1H4 | |
| SCHEMBL20952439 | 0.83 | NR1H4 (0.46) | NR1H4FABP1 | |
| SCHEMBL28895205 | 0.82 | NR1H4 (0.51) | NR1H4FABP1 | |
| SCHEMBL22789905 | 0.81 | TSHR (0.54) | TSHR | |
| SCHEMBL28417927 | 0.80 | NR1H4 (0.46) | NR1H4FABP1 | |
| SCHEMBL20043329 | 0.80 | NR1H4 (0.48) | NR1H4FABP1 | |
| SCHEMBL22790240 | 0.80 | GPBAR1 (0.41) | NR1H4FABP1 | |
| SCHEMBL12168747 | 0.79 | NR1H4 (0.55) | NR1H4FABP1 | |
| SCHEMBL22392584 | 0.77 | NR1H4 (0.51) | NR1H4FABP1 |
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-2020249064-A1 | COMPOUNDS FOR MODULATING FXR | NANJING RUIJIE PHARMA CO., LTD. (CN) | 2020-12-17 | — | — | WO | disclosed |