Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | ACHE | P22303 | 2/20 | 0.65 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | AR | P10275 | 3/20 | 0.53 |
| ▸ | LYN | P07948 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL29398372 | 0.97 | ALDH1A1 (0.72) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL29746015 | 0.97 | ALDH1A1 (0.72) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL456868 | 0.97 | ALDH1A1 (0.72) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL1688852 | 0.95 | ALDH1A1 (0.69) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL10013917 | 0.92 | ALDH1A1 (0.80) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL14159539 | 0.92 | ALDH1A1 (0.80) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL441890 | 0.90 | ALDH1A1 (0.70) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| Diphenylether SCHEMBL10909478 | 0.90 | ALDH1A1 (0.70) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL9486297 | 0.90 | ALDH1A1 (0.70) | ALDH1A1ACHEGAAHTTL3MBTL1 | |
| SCHEMBL19341802 | 0.88 | ALDH1A1 (0.68) | ALDH1A1ACHEGAAHTTL3MBTL1 |
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-114031639-A | Preparation method of biphosphonate with P-O-C-P structure | 烟台大学 | 2022-02-11 | — | — | CN | claimed |