Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 3/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL28888885 | 0.81 | ENPP2 (0.44) | ENPP2AR | |
| Boric Acid SCHEMBL28233693 | 0.78 | ACHE (0.38) | CA2CA9CA1ALDH1A1MAPT | |
| Boric Acid SCHEMBL28801697 | 0.78 | MEN1 (0.47) | ENPP2ALDH1A1ARKDM4EMEN1 | |
| SCHEMBL29210693 | 0.77 | ENPP2 (0.42) | ENPP2CA2CA9CA1ALDH1A1 | |
| Boric Acid SCHEMBL27924095 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MAPTPARP10RAB9AMEN1 | |
| Boric Acid SCHEMBL28032687 | 0.77 | MEN1 (0.31) | MAPTPPARAKDM4EMEN1KMT2A | |
| Boric Acid SCHEMBL28885301 | 0.77 | CA1 (0.43) | CA2CA9CA1ALDH1A1MAPT | |
| SCHEMBL506442 | 0.77 | KIF11 (0.41) | CA2CA9CA1ALDH1A1MAPT | |
| Boric Acid SCHEMBL28167570 | 0.76 | CA1 (0.36) | CA2CA1ALDH1A1MAPTPPARA | |
| SCHEMBL435736 | 0.75 | KIF11 (0.47) | CA2CA9CA1ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112898199-B | Organic electron transport material containing nitrogen atom heterocycle and benzonitrile and application thereof | 上海传勤新材料有限公司 | 2022-11-11 | — | — | CN | disclosed |
| CN-112898199-A | Organic electron transport material containing nitrogen atom heterocycle and benzonitrile and application thereof | 上海传勤新材料有限公司 | 2021-06-04 | — | — | CN | disclosed |