Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 2/20 | 0.56 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28635373 | 1.00 | PLA2G1B (0.56) | PLA2G1BATG4BALDH1A1KMT2ALMNA | |
| SCHEMBL28646790 | 0.93 | PLA2G1B (0.56) | PLA2G1BATG4BALDH1A1KMT2ALMNA | |
| SCHEMBL28646793 | 0.93 | PLA2G1B (0.56) | PLA2G1BATG4BALDH1A1KMT2ALMNA | |
| SCHEMBL28635370 | 0.88 | ALOX12 (0.50) | ALDH1A1KMT2ALMNAMEN1ALOX12 | |
| SCHEMBL28635369 | 0.88 | ALOX12 (0.50) | ALDH1A1KMT2ALMNAMEN1ALOX12 | |
| SCHEMBL28632720 | 0.83 | SMN1; SMN2 (0.56) | ALDH1A1KMT2ALMNAMEN1RAB9A | |
| SCHEMBL28632717 | 0.83 | SMN1; SMN2 (0.56) | ALDH1A1KMT2ALMNAMEN1RAB9A | |
| SCHEMBL28640297 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAMEN1ALOX12 | |
| SCHEMBL28640295 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAMEN1ALOX12 | |
| SCHEMBL28644082 | 0.77 | VNN1 (0.44) | KMT2ALMNAMEN1HPGDPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-113502491-A | Electrochemical preparation method of Tioxazafen and atrareum intermediate | 湖南大学 | 2021-10-15 | — | — | CN | disclosed |