Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 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 | |
|---|---|---|---|---|
| SCHEMBL31320121 | 0.84 | MAPK1 (0.38) | MAPK1KDM4EPOLBALDH1A1LMNA | |
| SCHEMBL31320134 | 0.82 | KDM4E (0.40) | MAPK1ATRKDM4EPOLBALDH1A1 | |
| SCHEMBL31320116 | 0.81 | MAPK1 (0.33) | MAPK1 | |
| SCHEMBL31320136 | 0.79 | GAA (0.51) | ATRKDM4EPOLBALDH1A1HSD17B10 | |
| SCHEMBL31320117 | 0.76 | KDM4E (0.39) | MAPK1ATRKDM4EPOLBALDH1A1 | |
| SCHEMBL28821124 | 0.72 | PSMD14 (0.43) | ATRKDM4EPOLBALDH1A1LMNA | |
| SCHEMBL28821097 | 0.69 | BACE1 (0.38) | KDM4EPOLBALDH1A1AAK1KMT2A | |
| SCHEMBL29100989 | 0.69 | MRGPRX4 (0.50) | KDM4EPOLBALDH1A1LMNAKMT2A | |
| SCHEMBL30630386 | 0.69 | MRGPRX4 (0.50) | KDM4EPOLBALDH1A1LMNAKMT2A | |
| SCHEMBL31320129 | 0.68 | SMN1; SMN2 (0.52) | MAPK1POLBALDH1A1ALOX15LMNA |
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 |