Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | CASP7 | P55210 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13382357 | 0.87 | ESR1 (0.64) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL26462184 | 0.85 | ESR1 (0.68) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL194068 | 0.84 | ESR1 (0.73) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL29514776 | 0.84 | ESR1 (0.73) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL29274263 | 0.84 | ESR1 (0.68) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL30956249 | 0.84 | ESR1 (0.68) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL23439830 | 0.82 | ESR1 (0.60) | ESR1ESR2ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL601251 | 0.82 | ESR1 (0.56) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL603134 | 0.82 | ESR1 (0.56) | ESR1ESR2KDM4ESMN1; SMN2MAOA | |
| SCHEMBL29446786 | 0.82 | KMT2A (0.56) | ESR1ESR2ALDH1A1HPGDSMN1; SMN2 |
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-118239888-A | Modularized synthesis method and application of acridine compound | 厦门大学 | 2024-06-25 | — | — | CN | disclosed |