Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23281215 | 0.84 | AHR (0.52) | AHRMEN1MAPTKMT2ATSHR | |
| SCHEMBL22825075 | 0.82 | ALDH1A1 (0.54) | AHRMEN1MAPTKMT2ATSHR | |
| SCHEMBL2389452 | 0.80 | ALDH1A1 (0.56) | AHRMEN1MAPTKMT2ATSHR | |
| SCHEMBL25490552 | 0.80 | AHR (0.48) | AHRKIF11MEN1MAPTKMT2A | |
| SCHEMBL18570306 | 0.77 | ALDH1A1 (0.43) | AHRABCG2MEN1MAPTKMT2A | |
| SCHEMBL1009963 | 0.77 | TRPV1 (0.62) | TRPV1MEN1MAPTKMT2ATSHR | |
| SCHEMBL22050052 | 0.76 | MAPT (0.56) | KIF11MEN1MAPTKMT2ATSHR | |
| Diphenylamine SCHEMBL29287150 | 0.76 | ALDH1A1 (0.62) | TRPV1ABCG2MEN1MAPTKMT2A | |
| SCHEMBL502030 | 0.76 | ALDH1A1 (0.62) | TRPV1ABCG2MEN1MAPTKMT2A | |
| SCHEMBL2392625 | 0.75 | TSHR (0.52) | TRPV1ABCG2KIF11MEN1MAPT |
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-107840834-B | Benzopyrene compound and application thereof | 北京鼎材科技有限公司 | 2022-10-04 | — | — | CN | disclosed |