Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A1 | P54219 | 1/20 | 0.59 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.55 |
| ▸ | GAA | P10253 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | CASP1 | P29466 | 2/20 | 0.55 |
| ▸ | CASP7 | P55210 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | GLA | P06280 | 2/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | HSD17B3 | P37058 | 5/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | SRC | P12931 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24623257 | 0.85 | SLC18A1 (0.52) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL22632226 | 0.84 | MTNR1B (0.60) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL8594115 | 0.84 | HSD17B3 (0.68) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL5138290 | 0.82 | HSD17B3 (0.66) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL8597625 | 0.81 | ALDH1A1 (0.70) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL24623284 | 0.81 | SLC18A1 (0.48) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL22632229 | 0.81 | SLC18A1 (0.50) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL22632087 | 0.81 | CYP2D6 (0.76) | ALDH1A1KDM4EGAAHPGDHSD17B10 | |
| SCHEMBL3127680 | 0.80 | ALDH1A1 (0.64) | SLC18A1SLC18A2ALDH1A1KDM4EGAA | |
| SCHEMBL8593488 | 0.79 | SRC (0.64) | SLC18A1SLC18A2ALDH1A1KDM4EGAA |
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-2020223174-A1 | COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER | HEALTH RESEARCH, INC. (US) | 2020-11-05 | — | — | WO | disclosed |