Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28688168 | 0.90 | MAPT (0.53) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28681669 | 0.90 | MAPT (0.56) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28930626 | 0.90 | MAPT (0.68) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28667773 | 0.88 | MAPT (0.62) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28667847 | 0.88 | MAPT (0.56) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28680258 | 0.88 | MAPT (0.53) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28665641 | 0.87 | MAPT (0.58) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28665714 | 0.87 | MAPT (0.64) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28661668 | 0.85 | MAPT (0.51) | MAPTGAATHRBALDH1A1TP53 | |
| SCHEMBL28676593 | 0.85 | MAPT (0.53) | MAPTGAATHRBALDH1A1TP53 |
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 |