Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.31 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28030496 | 0.95 | SMN1; SMN2 (0.34) | SMN1; SMN2 | |
| SCHEMBL393363 | 0.78 | ALDH1A1 (0.33) | ALDH1A1TDP1 | |
| SCHEMBL2833302 | 0.76 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL5051429 | 0.75 | ALDH1A1 (0.45) | ALDH1A1TDP1SPHK2SPHK1 | |
| SCHEMBL15461829 | 0.75 | ALDH1A1 (0.45) | ALDH1A1TDP1SPHK2SPHK1 | |
| SCHEMBL51692 | 0.75 | — | — | |
| SCHEMBL30215972 | 0.74 | — | — | |
| SCHEMBL30215975 | 0.74 | — | — | |
| SCHEMBL30215974 | 0.74 | — | — | |
| SCHEMBL30215971 | 0.74 | — | — |
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-105001061-A | Methoxy elgenol derivative and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2015-10-28 | — | — | CN | disclosed |