Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT1 | P26358 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | C1R | P00736 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL369327 | 0.88 | DNMT1 (0.50) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL30125426 | 0.88 | DNMT1 (0.50) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL1239327 | 0.84 | ALDH1A1 (0.55) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL30361992 | 0.84 | ALDH1A1 (0.55) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL24316338 | 0.82 | CYP2A6 (0.47) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL28769245 | 0.82 | DNMT1 (0.50) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL29674891 | 0.82 | CYP2A6 (0.48) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL13966913 | 0.82 | CYP2A6 (0.48) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL18174238 | 0.82 | POLB (0.50) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL18260194 | 0.81 | DNMT1 (0.44) | DNMT1ALDH1A1HSD17B10CYP2A6TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116836193-A | Organic compound, application thereof and organic electroluminescent device comprising same | 清华大学 | 2023-10-03 | — | — | CN | disclosed |
| CN-116178436-A | Phosphorus-containing polycyclic light-emitting compound, preparation method thereof and organic electroluminescent device | 奥来德(上海)光电材料科技有限公司 | 2023-05-30 | — | — | CN | disclosed |
| US-4898802-A | Toner compositions with organo boron negative charge enhancing additives | XEROX CORPORATION (US) | 1990-02-06 | — | — | US | disclosed |