Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28436731 | 0.82 | L3MBTL1 (0.56) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL16720449 | 0.80 | PTPN22 (0.38) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL484192 | 0.79 | MYC (0.46) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL2581647 | 0.78 | ALB (0.40) | ALBL3MBTL1POLBNOTUMNR4A1 | |
| SCHEMBL8926318 | 0.73 | HTR3A (0.45) | ALDH1A1L3MBTL1POLBAPEX1TDP1 | |
| SCHEMBL152899 | 0.73 | HSP90AA1 (0.50) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL154462 | 0.72 | NOTUM (0.50) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL30637639 | 0.72 | NPC1 (0.46) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL30928942 | 0.72 | NPC1 (0.46) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 | |
| SCHEMBL8610906 | 0.72 | NPC1 (0.46) | ALDH1A1HSP90AA1TRAP1HSP90AB1HSP90B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2383573-A1 | SCREENING METHOD FOR SUBSTANCE USEFUL AS AGENT FOR TREATING PROSTATE CANCER | Astellas Pharma Inc. (JP) | 2011-11-02 | — | — | EP | disclosed |