Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 6/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA4 | P22748 | 3/20 | 0.37 |
| ▸ | ULK1 | O75385 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL19705941 | 0.84 | GPBAR1 (0.43) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL19705735 | 0.83 | GPBAR1 (0.42) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL19698930 | 0.80 | GPBAR1 (0.40) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL19738292 | 0.79 | EGLN1 (0.40) | KDM4EATM | |
| SCHEMBL19725195 | 0.79 | GPBAR1 (0.40) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL24565981 | 0.77 | GPBAR1 (0.39) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL19705749 | 0.75 | GPBAR1 (0.38) | GPBAR1PPARDMRGPRX4ULK1MAPK14 | |
| SCHEMBL15601900 | 0.73 | GPBAR1 (0.42) | GPBAR1MRGPRX4CA2KDM4EHDAC1 | |
| SCHEMBL19725192 | 0.72 | HCAR2 (0.43) | KDM4E | |
| SCHEMBL15592423 | 0.70 | GPBAR1 (0.40) | GPBAR1MRGPRX4NR1H4 |
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-2017218330-A1 | FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2017-12-21 | — | — | WO | disclosed |