Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 5/20 | 0.34 |
| ▸ | HTR2A | P28223 | 4/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5202807 | 0.89 | POLB (0.40) | AOC3LMNAHRH1HTR2ASIGMAR1 | |
| SCHEMBL8121030 | 0.87 | NR1I2 (0.39) | HTR2ASIGMAR1OPRM1OPRD1OPRK1 | |
| SCHEMBL5206973 | 0.86 | NR1I2 (0.41) | HTR2ASIGMAR1OPRM1OPRD1OPRK1 | |
| SCHEMBL5203967 | 0.84 | LMNA (0.43) | AOC3LMNAHRH1HTR2ACCR5 | |
| SCHEMBL1263573 | 0.81 | AOC3 (0.48) | AOC3ESR1ESR2LMNAHRH1 | |
| SCHEMBL4354928 | 0.81 | CYP2C19 (0.46) | AOC3ESR1ESR2LMNAHRH1 | |
| SCHEMBL1546516 | 0.81 | AOC3 (0.40) | AOC3ESR1ESR2LMNAHRH1 | |
| SCHEMBL17183762 | 0.79 | AOC3 (0.39) | AOC3ESR1ESR2LMNAHRH1 | |
| SCHEMBL5853924 | 0.79 | AOC3 (0.39) | AOC3ESR1ESR2LMNAHRH1 | |
| SCHEMBL5853926 | 0.79 | AOC3 (0.39) | AOC3ESR1ESR2LMNAHRH1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0980867-B1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES (JP) | 2007-08-08 | — | — | EP | disclosed |
| US-6100292-A | Ketone derivatives and their medical applications | TORAY INDUSTRIES, INC. (JP) | 2000-08-08 | — | — | US | disclosed |
| EP-0980867-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 2000-02-23 | — | — | EP | disclosed |
| EP-0498680-A1 | New beta-amino-alpha-hydroxycarboxylic acids and their use | Sankyo Company Limited (JP) | 1992-08-12 | — | — | EP | disclosed |