Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 5/20 | 0.48 |
| ▸ | DRD4 | P21917 | 5/20 | 0.48 |
| ▸ | DRD3 | P35462 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL28670963 | 0.88 | MAPT (0.64) | MAPTLMNADRD2DRD4DRD3 | |
| SCHEMBL28676593 | 0.84 | MAPT (0.53) | S1PR1MAPTLMNANPC1HTT | |
| SCHEMBL28683437 | 0.83 | MAPT (0.55) | S1PR1MAPTLMNADRD4NPC1 | |
| SCHEMBL28670959 | 0.80 | MAPT (0.50) | S1PR1MAPTLMNANPC1ALDH1A1 | |
| SCHEMBL28665709 | 0.79 | MAPT (0.73) | MAPTLMNADRD2DRD3NPC1 | |
| SCHEMBL28665720 | 0.77 | MAPT (0.54) | MAPTLMNADRD3ALDH1A1HSD17B10 | |
| SCHEMBL28667773 | 0.76 | MAPT (0.62) | MAPTLMNANPC1HTTALDH1A1 | |
| SCHEMBL28688178 | 0.75 | MAPT (0.51) | MAPTLMNAALDH1A1THRBGAA | |
| SCHEMBL28681669 | 0.75 | MAPT (0.56) | MAPTLMNANPC1HTTALDH1A1 | |
| SCHEMBL28665714 | 0.75 | MAPT (0.64) | MAPTLMNADRD2NPC1HTT |
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-108658889-B | 1,2, 4-oxadiazole-aryl piperazine compound containing naphthalene ring and preparation method and application thereof | 贵州医科大学 | 2021-12-17 | — | — | CN | disclosed |