Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ESRRG | P62508 | 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 | |
|---|---|---|---|---|
| SCHEMBL19980943 | 0.85 | PHLPP2 (0.37) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL19980882 | 0.76 | HDAC3 (0.32) | — | |
| SCHEMBL24405259 | 0.73 | NR1H2 (0.45) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL8018099 | 0.72 | ALDH1A1 (0.50) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL143242 | 0.72 | CYP3A4 (0.61) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| Hydrochloric Acid SCHEMBL5697631 | 0.71 | CYP3A4 (0.59) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| Hydrochloric Acid SCHEMBL6657541 | 0.71 | CYP3A4 (0.59) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL14940571 | 0.71 | ALDH1A1 (0.48) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL34106 | 0.71 | ALDH1A1 (0.48) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 | |
| SCHEMBL45791 | 0.71 | CYP3A4 (0.59) | ALDH1A1CYP3A4MAPK1TDP1PSMD14 |
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-2601268-B1 | PARTICLES FOR ELECTROPHORETIC DISPLAYS | MERCK PATENT GMBH (DE) | 2018-03-21 | — | — | EP | disclosed |