Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 15/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 11/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.32 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28704100 | 0.85 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1MAPK14LMNATP53 | |
| SCHEMBL28701252 | 0.82 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1MAPK14 | |
| SCHEMBL13848422 | 0.82 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1MAPK14LMNATP53 | |
| SCHEMBL4377799 | 0.80 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1MAPK14HSP90B1TRAP1 | |
| SCHEMBL4071241 | 0.80 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1LMNATP53CYP1A2 | |
| SCHEMBL4396093 | 0.78 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1MAPK14HSP90B1TRAP1 | |
| SCHEMBL28701272 | 0.77 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1HSP90B1TRAP1 | |
| SCHEMBL4392433 | 0.76 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1MAPK14HSP90B1TRAP1 | |
| SCHEMBL28934605 | 0.75 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1ESR2MAPK14 | |
| SCHEMBL28691584 | 0.75 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1MAPK14LMNATP53 |
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-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |