Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28606163 | 1.00 | GAA (0.54) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28606166 | 1.00 | GAA (0.54) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28617810 | 1.00 | GAA (0.54) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28611349 | 0.92 | NPC1 (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28611345 | 0.92 | NPC1 (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28598732 | 0.88 | KMT2A (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28604029 | 0.88 | KMT2A (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28598734 | 0.88 | KMT2A (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28604026 | 0.88 | KMT2A (0.48) | GAAPOLBHTTRAB9AMEN1 | |
| SCHEMBL28618426 | 0.86 | ALDH1A1 (0.50) | GAAHTTRAB9AMEN1KMT2A |
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-108503600-B | Polysubstituted quinoxaline derivative and preparation method thereof | 华侨大学 | 2021-08-03 | — | — | CN | disclosed |