Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 10/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 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 | |
|---|---|---|---|---|
| SCHEMBL4060757 | 0.87 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1LMNATRPA1CHRM1 | |
| SCHEMBL13848090 | 0.83 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1LMNATRPA1CHRM1 | |
| SCHEMBL4065970 | 0.80 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1PTGS2PTGS1LMNA | |
| SCHEMBL4069860 | 0.79 | ACMSD (0.48) | HSP90AA1HSP90AB1LMNAAKR1C3AKR1C2 | |
| SCHEMBL9193961 | 0.78 | PTPN5 (0.50) | PTGS2PTGS1LMNASLC6A2HTR2B | |
| SCHEMBL4241557 | 0.78 | APP (0.50) | HSP90AA1HSP90AB1LMNATRPA1CHRM1 | |
| SCHEMBL25906339 | 0.78 | HSP90AA1 (0.60) | HSP90AA1HSP90AB1LMNATRPA1CHRM1 | |
| SCHEMBL15177384 | 0.77 | CA1 (0.59) | PTGS2PTGS1LMNASLC6A2HTR2B | |
| SCHEMBL4064793 | 0.76 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1LMNATRPA1CHRM1 | |
| SCHEMBL30427345 | 0.75 | LMNA (0.59) | PTGS1LMNATRPA1CHRM1SLC6A2 |
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 2 patents. 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 |
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |