Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.40 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 5/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7620798 | 0.98 | THRA (0.45) | THRAPTGESALOX5PPARGPDK2 | |
| Iodomethane SCHEMBL4620308 | 0.97 | THRA (0.45) | THRAPTGESALOX5PPARGPDK2 | |
| SCHEMBL7625930 | 0.97 | THRA (0.45) | THRAPTGESALOX5PPARGPDK2 | |
| SCHEMBL4617897 | 0.96 | THRA (0.44) | THRAPTGESALOX5PPARGPDK2 | |
| SCHEMBL7622073 | 0.96 | THRA (0.44) | THRAPTGESALOX5PPARGPDK2 | |
| SCHEMBL7043778 | 0.81 | MTNR1A (0.45) | LTA4HMTNR1AMTNR1B | |
| Trifluoromethanesulfonic Acid SCHEMBL7625092 | 0.80 | PDK2 (0.43) | THRAPTGESALOX5PPARGPDK2 | |
| Trifluoromethanesulfonic Acid SCHEMBL7620803 | 0.80 | PDK2 (0.43) | THRAPTGESALOX5PPARGPDK2 | |
| Trifluoromethanesulfonic Acid SCHEMBL4620311 | 0.79 | PDK2 (0.40) | PDK2PTPN11PLA2G4BGGPS1DHFR | |
| Trifluoromethanesulfonic Acid SCHEMBL4617899 | 0.77 | PDK2 (0.39) | THRAPDK2PTPN11PLA2G4BGGPS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6437090-B1 | ORGANOMETALLIC COMPOUND CAPABLE OF REVERSIBLY DISSOLVING AND PRECIPITATING THROUGH HEATING AND COOLING; ORGANOSILICON COMPOUND; ONE LIGAND CONTAINS AN ALKYL GROUP HAVING 10 OR MORE CARBON ATOMS; EPOXY RESIN; STORAGE STABLE; ONLY CURES ON HEAT | KABUSHIKI KAISHA TOSHIBA (JP) | 2002-08-20 | — | — | US | disclosed |