Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT1 | P26358 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.44 |
| ▸ | BACE1 | P56817 | 5/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | PTPRF | P10586 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL11790344 | 0.79 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL10959580 | 0.79 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL8650629 | 0.76 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL28755138 | 0.76 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL8210093 | 0.76 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL29708071 | 0.76 | DNMT1 (0.49) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL8198269 | 0.75 | DNMT1 (0.45) | DNMT1CYP1A2CYP1A1CYP1B1PTPRC | |
| SCHEMBL6364879 | 0.74 | DNMT1 (0.44) | DNMT1PTPRCMAPTALDH1A1KDM4E | |
| SCHEMBL10408712 | 0.73 | DNMT1 (0.46) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 | |
| SCHEMBL9550498 | 0.72 | DNMT1 (0.45) | DNMT1CYP1A2CYP1A1CYP1B1PTPN1 |
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-112961176-B | Preparation method of boron-dioxygen ring neutral radical compound | 南京大学 | 2022-05-17 | — | — | CN | disclosed |