Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP14 | Q460N5 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ACLY | P53396 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.42 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.41 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.41 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13848251 | 0.91 | PTGES2 (0.53) | PARP14ALDH1A1GAAHTTHSD17B10 | |
| SCHEMBL13848260 | 0.87 | ALDH1A1 (0.47) | PARP14ALDH1A1GAAHTTHSD17B10 | |
| SCHEMBL13848265 | 0.84 | PARP14 (0.49) | PARP14ALDH1A1GAAHTTHSD17B10 | |
| SCHEMBL13848087 | 0.81 | L3MBTL1 (0.59) | PARP14ALDH1A1GAAHTTHSD17B10 | |
| SCHEMBL13848473 | 0.81 | ALDH1A1 (0.54) | PARP14ALDH1A1HTTACLYMAPK1 | |
| SCHEMBL13848412 | 0.81 | BRD4 (0.51) | ALDH1A1GAAHTTHSD17B10ACLY | |
| SCHEMBL13848248 | 0.76 | PTGES2 (0.45) | ALDH1A1GAAHSD17B10HSP90AA1HSP90AB1 | |
| SCHEMBL13848332 | 0.76 | PGAM1 (0.46) | ALDH1A1GAAHTTHSD17B10HSP90AA1 | |
| SCHEMBL13848086 | 0.75 | ALDH1A1 (0.69) | ALDH1A1GAAHTTHSD17B10PGAM1 | |
| SCHEMBL6566936 | 0.75 | CA1 (0.56) | PARP14ALDH1A1GAAHTTHSD17B10 |
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 |