Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30735764 | 1.00 | ALDH1A1 (0.33) | ALDH1A1CYP2C9TDP2KDM1AMAOB | |
| SCHEMBL30735881 | 0.84 | SIGMAR1 (0.33) | SIGMAR1 | |
| SCHEMBL30735516 | 0.82 | ESR1 (0.40) | ALDH1A1SLC6A2SLC6A4SLC6A3CYP1A2 | |
| SCHEMBL30735767 | 0.80 | KIF11 (0.40) | SLC6A2TSHRNPC1RAB9A | |
| SCHEMBL30735913 | 0.80 | CYP3A4 (0.42) | ALDH1A1MAOBSLC6A2SLC6A3CYP3A4 | |
| SCHEMBL30735648 | 0.77 | RXRA (0.33) | — | |
| SCHEMBL30735657 | 0.72 | KDM1A (0.41) | ALDH1A1CYP2C9KDM1AMAOBHTR2A | |
| SCHEMBL30735679 | 0.71 | SIGMAR1 (0.33) | SIGMAR1 | |
| SCHEMBL666915 | 0.71 | HTR2A (0.55) | ALDH1A1CYP2C9KDM1AMAOBHTR2A | |
| SCHEMBL31084187 | 0.69 | HTR2A (0.46) | ALDH1A1CYP2C9KDM1AMAOBHTR2A |
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-117430636-A | Chiral spiro phosphoramide compound and preparation method and application thereof | 南开大学 | 2024-01-23 | — | — | CN | disclosed |