Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.33 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31024004 | 0.82 | ALDH1A1 (0.59) | ALDH1A1TDP1HSD17B10CYP3A4ATM | |
| SCHEMBL10843574 | 0.82 | ALDH1A1 (0.59) | ALDH1A1TDP1HSD17B10CYP3A4ATM | |
| SCHEMBL11700989 | 0.78 | ALDH1A1 (0.37) | ALDH1A1TDP1 | |
| SCHEMBL81382 | 0.75 | ALDH1A1 (0.64) | ALDH1A1TDP1HSD17B10CYP3A4ATM | |
| SCHEMBL10064075 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1MAPTKDM4E | |
| SCHEMBL29399800 | 0.75 | ALDH1A1 (0.64) | ALDH1A1TDP1HSD17B10CYP3A4ATM | |
| SCHEMBL30360736 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1MAPTKDM4E | |
| SCHEMBL4149733 | 0.74 | DYRK1A (0.57) | MAPTDYRK1ADYRK1BDYRK2RAB9A | |
| Hydrogen Sulfide SCHEMBL29194396 | 0.73 | ALDH1A1 (0.62) | ALDH1A1TDP1HSD17B10CYP3A4ATM | |
| Hydrogen Sulfide SCHEMBL30782703 | 0.73 | ALDH1A1 (0.62) | ALDH1A1TDP1HSD17B10CYP3A4ATM |
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-117069732-B | Preparation method of benzo [ c ] phenanthridine natural product and derivative thereof | 沈阳药科大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-117069732-A | Preparation method of benzo [ c ] phenanthridine natural product and derivative thereof | 沈阳药科大学 | 2023-11-17 | — | — | CN | disclosed |