Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 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 | |
|---|---|---|---|---|
| SCHEMBL13848383 | 0.88 | KMT2A (0.47) | MAPTMAPK1HRH3ALDH1A1CYP1A2 | |
| SCHEMBL4069471 | 0.87 | EGFR (0.43) | TLR9TLR8TLR7EGFRHPGD | |
| SCHEMBL13848378 | 0.86 | RAB9A (0.47) | TLR7HPGDHRH3MEN1KMT2A | |
| SCHEMBL4388807 | 0.82 | HSP90AA1 (0.47) | TLR9TLR8TLR7EGFRCYP3A4 | |
| SCHEMBL13848085 | 0.82 | HSP90AA1 (0.37) | MAPTMAPK1HRH3ALDH1A1CYP1A2 | |
| SCHEMBL13848454 | 0.79 | NPC1 (0.44) | TLR7HPGDHRH3ALDH1A1MEN1 | |
| SCHEMBL13848385 | 0.79 | TSHR (0.44) | HPGDHRH3MEN1KMT2ABACE1 | |
| SCHEMBL13848084 | 0.78 | TSHR (0.46) | TLR7HPGDHRH3MEN1KMT2A | |
| SCHEMBL13848091 | 0.78 | IDO1 (0.39) | HPGDCYP3A4CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL13848452 | 0.78 | MAPK14 (0.37) | CYP2C9CYP1A2CYP2C19 |
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 |