Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24921040 | 0.88 | AOC3 (0.44) | ACHEAOC3CA12CA1CA2 | |
| SCHEMBL24921023 | 0.88 | AOC3 (0.44) | ACHEAOC3CA12CA1CA2 | |
| SCHEMBL24920520 | 0.86 | MAPT (0.46) | ACHEAOC3CA12CA1CA2 | |
| SCHEMBL24920536 | 0.85 | ACHE (0.48) | ACHEAOC3CA12CA1CA2 | |
| SCHEMBL24920523 | 0.84 | ADRB1 (0.51) | ACHEAOC3HRH4HTR3AHRH3 | |
| SCHEMBL30230267 | 0.83 | HTR1A (0.56) | ACHEHRH4HTR3AHTR1ADRD2 | |
| SCHEMBL16815333 | 0.81 | ACHE (0.50) | ACHEHRH4HTR3AHTR1ADRD2 | |
| SCHEMBL24920516 | 0.80 | HSD17B10 (0.41) | AOC3ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL24921022 | 0.79 | AOC3 (0.38) | ACHEAOC3HTR2A | |
| SCHEMBL24921025 | 0.78 | RXRA (0.39) | AOC3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |