Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 6/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28702735 | 0.93 | HSP90AA1 (0.46) | HSP90AA1CYP3A4CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL28704117 | 0.84 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL4377799 | 0.82 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1 | |
| SCHEMBL28701261 | 0.82 | MAPK14 (0.49) | HSP90AA1HSP90AB1 | |
| SCHEMBL28710751 | 0.81 | MAPK14 (0.46) | HSP90AA1HSP90AB1 | |
| SCHEMBL4392433 | 0.78 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1CYP11B1CYP11B2ALOX5 | |
| SCHEMBL13848073 | 0.78 | CYP19A1 (0.45) | CYP3A4CYP2C9CYP2C19KDM4ENPC1 | |
| SCHEMBL4383317 | 0.78 | HSP90AA1 (0.52) | HSP90AA1CYP3A4CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL28934605 | 0.78 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1 | |
| SCHEMBL4063115 | 0.78 | CYP11B1 (0.45) | CYP19A1CYP11B1CYP11B2 |
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 |