Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 8/20 | 0.34 |
| ▸ | NPC1 | O15118 | 6/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8501242 | 0.98 | RAB9A (0.35) | ALDH1A1CYP1A2CYP2A6MAPK1RAB9A | |
| SCHEMBL11021176 | 0.92 | RAB9A (0.31) | ALDH1A1CYP1A2CYP2A6MAPK1RAB9A | |
| SCHEMBL11110746 | 0.92 | RAB9A (0.31) | ALDH1A1CYP1A2CYP2A6MAPK1RAB9A | |
| SCHEMBL29956971 | 0.77 | RAB9A (0.38) | ALDH1A1CYP1A2CYP2A6MAPK1RAB9A | |
| SCHEMBL12156965 | 0.76 | TDP1 (0.42) | ALDH1A1CYP1A2CYP2A6RAB9ANPC1 | |
| SCHEMBL14020050 | 0.73 | TRPA1 (0.52) | ALDH1A1CYP1A2CYP2A6RAB9ANPC1 | |
| SCHEMBL11583621 | 0.73 | TDP1 (0.52) | ALDH1A1CYP1A2CYP2A6MAPK1RAB9A | |
| SCHEMBL972024 | 0.70 | — | — | |
| SCHEMBL28034889 | 0.70 | TDP1 (0.37) | ALDH1A1CYP1A2CYP2A6SMN1; SMN2TDP1 | |
| SCHEMBL29471000 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0599270-B1 | Method of detecting phosphatase | AISIN SEIKI (JP) | 1999-05-12 | — | — | EP | claimed |