Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7164686 | 1.00 | AR (0.39) | ARRELANOS2ABCG2MAOB | |
| SCHEMBL7140087 | 0.91 | AR (0.39) | ARRELANOS2ABCG2MAPT | |
| SCHEMBL7140095 | 0.91 | AR (0.39) | ARRELANOS2ABCG2MAPT | |
| SCHEMBL7135431 | 0.88 | NFE2L2 (0.44) | ARRELAMAOBHTR2AHTR2C | |
| SCHEMBL7135430 | 0.88 | NFE2L2 (0.44) | ARRELAMAOBHTR2AHTR2C | |
| SCHEMBL7142484 | 0.87 | RAB9A (0.36) | RELAABCG2MAOBMAPTPTPN5 | |
| SCHEMBL7142487 | 0.87 | RAB9A (0.36) | RELAABCG2MAOBMAPTPTPN5 | |
| SCHEMBL7140184 | 0.84 | MAOB (0.43) | ARRELAMAOBMAPT | |
| SCHEMBL7140189 | 0.84 | MAOB (0.43) | ARRELAMAOBMAPT | |
| SCHEMBL7140078 | 0.83 | TUBB4A (0.40) | ARABCG2MAOB |
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-0996439-B1 | BETA-ALKOXYACRYLATES AGAINST MALARIA | HOFFMANN LA ROCHE (CH) | 2003-01-08 | — | — | EP | claimed |