Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN5 | P54829 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 4/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL24910315 | 0.83 | AR (0.41) | PTPN5CTSACNR2TACR1AKR1C3 | |
| SCHEMBL24910314 | 0.80 | PTPN5 (0.54) | PTPN5ALDH1A1GAAATMHTR2A | |
| SCHEMBL21766566 | 0.79 | RXRA (0.40) | PTPN5ALDH1A1GAAATMCTSA | |
| SCHEMBL26375466 | 0.78 | NOTUM (0.41) | PTPN5ALDH1A1CNR1CNR2 | |
| SCHEMBL24780609 | 0.78 | KIF11 (0.48) | PTPN5ALDH1A1TACR1AKR1C3AKR1C2 | |
| SCHEMBL21766567 | 0.78 | IKBKB (0.35) | PTPN5ALDH1A1GAAATMCTSA | |
| SCHEMBL21766570 | 0.76 | ALOX5AP (0.41) | CTSAAKR1C3AKR1C2 | |
| SCHEMBL24910183 | 0.76 | PTPN5 (0.47) | PTPN5ALDH1A1GAAATMAKR1C3 | |
| SCHEMBL24754923 | 0.76 | CES2 (0.37) | PTPN5ALDH1A1GAAATMCTSA | |
| SCHEMBL24910321 | 0.76 | PSEN1 (0.50) | PTPN5AKR1C3AKR1C2 |
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-4122934-A1 | ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE | Beijing Summer Sprout Technology Co., Ltd. (CN) | 2023-01-25 | — | — | EP | disclosed |