Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 7/20 | 0.41 |
| ▸ | NQO2 | P16083 | 6/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | STS | P08842 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20241215 | 0.84 | BRD4 (0.43) | CYP26A1BRD4CYP24A1MTNR1AMAPT | |
| SCHEMBL18322124 | 0.81 | NPC1 (0.48) | CYP26A1BRD4CYP24A1MTNR1ANQO2 | |
| SCHEMBL28615795 | 0.78 | THRB (0.50) | CYP26A1BRD4CYP24A1KDM4EMAPT | |
| SCHEMBL18322201 | 0.78 | THRB (0.50) | CYP26A1BRD4CYP24A1KDM4EMAPT | |
| SCHEMBL5206057 | 0.78 | MAOB (0.42) | CYP26A1BRD4CYP24A1MAPTSTS | |
| SCHEMBL18322205 | 0.77 | NR1H4 (0.47) | MTNR1ANQO2MTNR1BKDM4EMAPT | |
| SCHEMBL20241344 | 0.77 | NR1H4 (0.47) | MTNR1ANQO2MTNR1BKDM4EMAPT | |
| SCHEMBL18321967 | 0.74 | MTNR1A (0.37) | MTNR1ANQO2MTNR1BALDH1A1 | |
| SCHEMBL18321982 | 0.73 | FFAR1 (0.41) | CYP26A1BRD4CYP24A1 | |
| SCHEMBL18321978 | 0.73 | BRD4 (0.38) | CYP26A1BRD4CYP24A1DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137557-B | Nrf2 modulators | 葛兰素史密斯克莱知识产权发展有限公司 | 2021-09-07 | — | — | CN | disclosed |