Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4620920 | 1.00 | ALDH1A1 (0.46) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4621768 | 1.00 | ALDH1A1 (0.46) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL29087844 | 0.88 | ALDH1A1 (0.47) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4624373 | 0.81 | ALDH1A1 (0.42) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4621338 | 0.81 | ALDH1A1 (0.42) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4622143 | 0.81 | ALDH1A1 (0.42) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL2784303 | 0.80 | ALDH1A1 (0.62) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4621349 | 0.79 | PGR (0.49) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4621225 | 0.79 | PGR (0.49) | ALDH1A1PKMKMT2ATSHRTP53 | |
| SCHEMBL4618951 | 0.79 | PGR (0.49) | ALDH1A1PKMKMT2ATSHRTP53 |
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-1884230-A1 | PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN | Shiseido Company, Limited (JP) | 2008-02-06 | — | — | EP | disclosed |