Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29128173 | 0.87 | HTT (0.40) | HTTLMNATDP1NPSR1ALDH1A1 | |
| SCHEMBL29128273 | 0.85 | ALDH1A1 (0.35) | HTTLMNANPSR1ALDH1A1KDM4E | |
| SCHEMBL29128473 | 0.82 | MAPT (0.37) | HTTLMNATDP1NPSR1ALDH1A1 | |
| SCHEMBL29128468 | 0.81 | ALDH1A1 (0.33) | ALDH1A1KDM4EGAA | |
| SCHEMBL29128185 | 0.81 | ALDH1A1 (0.39) | HTTLMNANPSR1ALDH1A1KDM4E | |
| SCHEMBL29128354 | 0.80 | ALDH1A1 (0.59) | HTTLMNATDP1ALDH1A1KDM4E | |
| SCHEMBL29128340 | 0.80 | ALDH1A1 (0.37) | HTTLMNAALDH1A1KDM4E | |
| SCHEMBL29128167 | 0.79 | ALDH1A1 (0.36) | HTTLMNATDP1ALDH1A1KDM4E | |
| SCHEMBL29128245 | 0.77 | L3MBTL1 (0.40) | HTTLMNATDP1ALDH1A1KDM4E | |
| SCHEMBL29128488 | 0.77 | L3MBTL1 (0.43) | TDP1ALDH1A1KDM4ECYP1A2CYP2D6 |
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-117263862-A | Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof | 吉首大学 | 2023-12-22 | — | — | CN | disclosed |