Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | SLC7A5 | Q01650 | 4/20 | 0.48 |
| ▸ | LCK | P06239 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23447581 | 0.89 | ALDH1A1 (0.53) | SLC7A5LCKKDM4EUSP2EGFR | |
| SCHEMBL13126535 | 0.87 | ALDH1A1 (0.48) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL13126527 | 0.87 | ALDH1A1 (0.46) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL13126799 | 0.87 | ALDH1A1 (0.46) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL13126522 | 0.87 | ALDH1A1 (0.46) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL13126788 | 0.87 | ALDH1A1 (0.46) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL13126801 | 0.84 | ALDH1A1 (0.43) | BACE1SLC7A5LCKKDM4EUSP2 | |
| SCHEMBL3995465 | 0.84 | TPH1 (0.47) | SLC7A5PTGS1ALDH1A1TPH1 | |
| SCHEMBL6504755 | 0.83 | CSNK2A1 (0.51) | SLC7A5ALOX15HSD17B10TDP1ALDH1A1 | |
| SCHEMBL7229409 | 0.83 | ALDH1A1 (0.55) | ALDH1A1TPH1 |
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-2010112211-A1 | METHOD FOR ARYLATING RING-SUBSTITUTED PHENOLS AND PHENYLETHERS | Technische Universität München (DE) | 2010-10-07 | — | — | WO | disclosed |