Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7901284 | 0.86 | RAB9A (0.42) | MAPTALDH1A1HSD17B3RAB9ANPC1 | |
| SCHEMBL29809356 | 0.86 | RAB9A (0.42) | MAPTALDH1A1HSD17B3RAB9ANPC1 | |
| SCHEMBL1553150 | 0.80 | NPC1 (0.44) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL30284584 | 0.80 | NPC1 (0.44) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2576469 | 0.80 | PARP1 (0.33) | ALDH1A1HSD17B3PARP1HDAC3TAS1R3 | |
| SCHEMBL30633069 | 0.79 | NPC1 (0.43) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1356606 | 0.79 | NPC1 (0.43) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL31612033 | 0.79 | NPC1 (0.43) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28153735 | 0.79 | NPC1 (0.43) | MAPTHSD17B3RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28013252 | 0.78 | MAPT (0.34) | MAPTALDH1A1HSD17B3RAB9ANPC1 |
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-106083718-B | Isoquinoline-1, 3, 4-trione derivative and preparation method thereof | 苏州大学 | 2018-11-02 | — | — | CN | disclosed |