Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 11/20 | 0.45 |
| ▸ | TRAP1 | Q12931 | 4/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | HTR7 | P34969 | 3/20 | 0.32 |
| ▸ | HTR6 | P50406 | 3/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | GCGR | P47871 | 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 | |
|---|---|---|---|---|
| SCHEMBL8100876 | 0.91 | HSP90B1 (0.43) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL6966836 | 0.88 | HSP90B1 (0.43) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL6957208 | 0.88 | HSP90B1 (0.35) | HSP90B1TRAP1HSP90AA1HSP90AB1DRD2 | |
| SCHEMBL6974129 | 0.86 | HSP90B1 (0.41) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL7079137 | 0.85 | HSP90B1 (0.41) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL6962803 | 0.84 | HSP90B1 (0.32) | HSP90B1TRAP1HSP90AA1HSP90AB1DRD2 | |
| SCHEMBL7081625 | 0.84 | HSP90B1 (0.39) | HSP90B1TRAP1HSP90AA1HSP90AB1GCGR | |
| SCHEMBL6965783 | 0.84 | HSP90B1 (0.39) | HSP90B1TRAP1HSP90AA1HSP90AB1GCGR | |
| SCHEMBL8100874 | 0.84 | HSP90B1 (0.45) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL6974759 | 0.83 | HSP90B1 (0.40) | HSP90B1TRAP1HSP90AA1HSP90AB1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| 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 |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |