Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31315697 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL31315691 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL31315682 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL31315687 | 0.78 | ALDH1A1 (0.59) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL31315698 | 0.77 | ALDH1A1 (0.54) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL30020933 | 0.73 | KDM4E (0.54) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL31707340 | 0.72 | KDM4E (0.72) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL2944008 | 0.71 | RAB9A (0.54) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL28444260 | 0.71 | HPGD (0.69) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL5798716 | 0.71 | KDM4E (0.55) | NPC1RAB9AHTTSMN1; SMN2ALDH1A1 |
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-115233244-B | Method for electrochemically synthesizing 3-hydroxyalkyl quinoxaline-2 (1H) -ketone compound | 桂林医学院 | 2024-12-27 | — | — | CN | disclosed |