Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31320136 | 0.87 | GAA (0.51) | KDM4EPOLBALDH1A1HSD17B10ALOX15 | |
| SCHEMBL31320117 | 0.84 | KDM4E (0.39) | KDM4EPOLBALDH1A1HSD17B10ALOX15 | |
| SCHEMBL31320123 | 0.82 | MAPK1 (0.37) | KDM4EPOLBALDH1A1HSD17B10ALOX15 | |
| SCHEMBL28821124 | 0.79 | PSMD14 (0.43) | KDM4EPOLBALDH1A1GLAPSMD14 | |
| SCHEMBL31320129 | 0.75 | SMN1; SMN2 (0.52) | POLBALDH1A1ALOX15MAPK1TSHR | |
| SCHEMBL31320132 | 0.72 | ALDH1A1 (0.51) | KDM4EPOLBALDH1A1HSD17B10GLA | |
| SCHEMBL9885829 | 0.71 | KDM4E (0.53) | KDM4EPOLBALDH1A1HSD17B10ALOX15 | |
| SCHEMBL16198463 | 0.71 | KDM4E (0.46) | KDM4EPOLBALDH1A1HSD17B10GLA | |
| SCHEMBL18430885 | 0.70 | NPC1 (0.45) | KDM4EPOLBALDH1A1GLAPSMD14 | |
| SCHEMBL29023470 | 0.69 | AAK1 (0.40) | KDM4EPOLBALDH1A1PSMD14L3MBTL1 |
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-2024240108-A1 | ARYL UREA PARP1 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海海和药物研究开发股份有限公司 | 2024-11-28 | — | — | WO | disclosed |