Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GPR3 | P46089 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 2/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28231296 | 0.84 | HTR1D (0.47) | ALDH1A1KIF11KDM4EGPR3PGR | |
| SCHEMBL25922312 | 0.84 | ESR1 (0.46) | ALDH1A1ESR1ESR2CYP3A4KIF11 | |
| SCHEMBL13589177 | 0.82 | ESR1 (0.44) | ALDH1A1ESR1ESR2CYP3A4KDM4E | |
| SCHEMBL25917218 | 0.81 | ESR1 (0.43) | ALDH1A1ESR1ESR2CYP3A4KIF11 | |
| SCHEMBL16303830 | 0.81 | TSHR (0.45) | ALDH1A1ESR1KIF11KDM4EPGR | |
| SCHEMBL16303827 | 0.80 | BCHE (0.43) | ALDH1A1ESR1ESR2KIF11KDM4E | |
| SCHEMBL2604384 | 0.80 | HTR1D (0.50) | ALDH1A1KIF11KDM4EGPR3PGR | |
| SCHEMBL2604375 | 0.79 | GPR3 (0.61) | ALDH1A1KIF11KDM4EGPR3PGR | |
| SCHEMBL14649228 | 0.79 | KIF11 (0.48) | ALDH1A1KIF11KDM4EGPR3PGR | |
| SCHEMBL25523207 | 0.77 | GRM2 (0.44) | ALDH1A1KIF11KDM4EGPR3PGR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023142485-A1 | BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 季华恒烨(佛山)电子材料有限公司 | 2023-08-03 | — | — | WO | disclosed |
| WO-2023142486-A1 | BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 季华恒烨(佛山)电子材料有限公司 | 2023-08-03 | — | — | WO | disclosed |