Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | GAA | P10253 | 3/20 | 0.68 |
| ▸ | POLB | P06746 | 3/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.65 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL21848554 | 0.89 | ALDH1A1 (0.55) | ALDH1A1GAAPOLBL3MBTL1HSD11B1 | |
| SCHEMBL19597541 | 0.84 | ALDH1A1 (0.70) | ALDH1A1GAAPOLBL3MBTL1HSD11B1 | |
| SCHEMBL19597540 | 0.84 | ALDH1A1 (0.70) | ALDH1A1GAAPOLBL3MBTL1HSD11B1 | |
| SCHEMBL542345 | 0.83 | ALDH1A1 (0.65) | ALDH1A1GAAPOLBL3MBTL1HSD11B1 | |
| SCHEMBL392680 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL478614 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL4861809 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL30216480 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL27268932 | 0.81 | PKM (0.51) | ALDH1A1GAAPOLBL3MBTL1HSD11B1 | |
| Hydrochloric Acid SCHEMBL7840775 | 0.80 | ALDH1A1 (0.97) | ALDH1A1GAAPOLBL3MBTL1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020063399-A1 | METHOD FOR LIGHT-INDUCED DECARBOXYLATION COUPLING OF ACTIVE CARBOXYLIC ACID ESTER UNDER NON-METAL CATALYSIS | 中国科学技术大学 | 2020-04-02 | — | — | WO | disclosed |