Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19951043 | 0.82 | KDM4E (0.55) | KDM4EGLAMAPTPOLBDGAT1 | |
| SCHEMBL29337875 | 0.82 | DGAT1 (0.48) | KDM4EGLAMAPTPOLBDGAT1 | |
| SCHEMBL16397204 | 0.80 | KDM4E (0.46) | KDM4EGLAMAPTPOLBHSD17B10 | |
| SCHEMBL16461500 | 0.80 | CES2 (0.42) | PTGDR2MAOBMAOADGAT1HSD17B10 | |
| SCHEMBL1734943 | 0.78 | AKR1C3 (0.42) | KDM4EGLAMAPTPOLBPTGDR2 | |
| SCHEMBL13468056 | 0.78 | KDM4E (0.46) | KDM4EGLAMAPTPOLBPTGDR2 | |
| SCHEMBL4092168 | 0.77 | DGAT1 (0.43) | KDM4EGLAMAPTPOLBPTGDR2 | |
| SCHEMBL30353604 | 0.77 | DGAT1 (0.43) | KDM4EGLAMAPTPOLBPTGDR2 | |
| SCHEMBL16722476 | 0.77 | ALDH1A1 (0.40) | MAPTPTGDR2MAOBMAOAPLAU | |
| SCHEMBL1730460 | 0.74 | HSD17B10 (0.50) | KDM4EGLAMAPTPOLBPTGDR2 |
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-4400497-A1 | 3CLPRO PROTEASE INHIBITOR | Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) | 2024-07-17 | — | — | EP | disclosed |