Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8343685 | 0.83 | KCNH2 (0.37) | HSP90B1TRAP1 | |
| SCHEMBL8345289 | 0.83 | DRD2 (0.32) | HSP90B1TRAP1HSP90AA1HSP90AB1 | |
| SCHEMBL8800652 | 0.83 | NPC1 (0.32) | NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL6961592 | 0.83 | HSP90B1 (0.33) | HSP90B1ALDH1A1HPGDTRAP1HSP90AA1 | |
| SCHEMBL6160601 | 0.82 | HSP90B1 (0.33) | HSP90B1NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL6961520 | 0.80 | HSP90B1 (0.32) | HSP90B1TRAP1HSP90AA1HSP90AB1 | |
| SCHEMBL6957208 | 0.80 | HSP90B1 (0.35) | HSP90B1TRAP1HSP90AA1HSP90AB1 | |
| SCHEMBL6969512 | 0.79 | TSHR (0.39) | HSP90B1TRAP1 | |
| SCHEMBL6969836 | 0.79 | HSP90B1 (0.32) | HSP90B1TRAP1HSP90AA1HSP90AB1 | |
| SCHEMBL6968701 | 0.78 | TLR8 (0.36) | HSP90B1ALDH1A1TRAP1HSP90AA1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |