Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 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 | |
|---|---|---|---|---|
| SCHEMBL6664833 | 0.82 | MAOB (0.58) | MAOBTSHRIDO1KMT2ALTA4H | |
| SCHEMBL9618105 | 0.81 | MAOB (0.48) | PPARGPPARAMAOBALDH1A1MEN1 | |
| SCHEMBL6667272 | 0.78 | MAOB (0.48) | MAOBALDH1A1MRGPRX4IDO1MEN1 | |
| SCHEMBL6666271 | 0.78 | MAOB (0.48) | PPARGPPARAMAOBMAPK14MEN1 | |
| SCHEMBL2360573 | 0.78 | LTA4H (0.53) | MAOBALDH1A1TSHRLTA4H | |
| SCHEMBL6664995 | 0.78 | MAOB (0.48) | PPARGPPARAMAOB | |
| SCHEMBL2360572 | 0.78 | LTA4H (0.53) | MAOBALDH1A1TSHRLTA4H | |
| SCHEMBL28720973 | 0.75 | MAOB (0.45) | PPARGMAOBALDH1A1KMT2A | |
| SCHEMBL9618106 | 0.75 | MAOB (0.43) | MAOBIDO1MEN1KMT2ALTA4H | |
| SCHEMBL6665182 | 0.73 | LTA4H (0.52) | MAOBALDH1A1TSHRIDO1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004024684-A2 | ENANTIOSELECTIVE AMINATION AND ETHERIFICATION | YALE UNIVERSITY (US) | 2004-03-25 | — | — | WO | disclosed |