Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | RORA | P35398 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RORB | Q92753 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28842795 | 0.89 | METAP2 (0.39) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL28842622 | 0.86 | PTGS2 (0.43) | ALDH1A1NFKB1MAPTNPSR1ATM | |
| SCHEMBL29960213 | 0.81 | HSP90AA1 (0.43) | ALDH1A1NFKB1MAPTNPSR1ATM | |
| SCHEMBL24522143 | 0.77 | KIF11 (0.40) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL28842827 | 0.76 | MGLL (0.46) | ALDH1A1L3MBTL1MAPTATMP2RX4 | |
| SCHEMBL28842855 | 0.76 | KIF11 (0.51) | ALDH1A1NFKB1L3MBTL1MAPTNPSR1 | |
| SCHEMBL13311194 | 0.74 | PPARG (0.46) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL16231003 | 0.73 | KIF11 (0.46) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL29960034 | 0.71 | KIF11 (0.47) | ALDH1A1NFKB1L3MBTL1MAPTMAPK1 | |
| SCHEMBL17622320 | 0.71 | PGR (0.41) | PGRRORARORCRORBALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115043735-B | Reaction method of secondary amine and o-diiodobenzene | 苏州大学 | 2024-07-05 | — | — | CN | disclosed |
| CN-115043735-A | Reaction method of secondary amine and o-diiodobenzene | 苏州大学 | 2022-09-13 | — | — | CN | disclosed |