Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 10/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL13848266 | 0.87 | L3MBTL1 (0.54) | CYP17A1PGAM1ALOX5APFEN1L3MBTL1 | |
| SCHEMBL4544247 | 0.82 | HSD17B10 (0.47) | MRGPRX1CYP17A1ALOX5APFEN1LPAR1 | |
| SCHEMBL13848332 | 0.81 | PGAM1 (0.46) | MRGPRX1PGAM1ALOX5APFEN1TSPO | |
| SCHEMBL13848277 | 0.79 | PARP14 (0.46) | CYP17A1PGAM1ALOX5APFEN1 | |
| SCHEMBL13848473 | 0.78 | ALDH1A1 (0.54) | CYP17A1 | |
| SCHEMBL13848365 | 0.78 | ALDH1A1 (0.61) | PGAM1L3MBTL1HTR6 | |
| SCHEMBL13848367 | 0.77 | MEN1 (0.65) | CYP17A1PGAM1HTR6 | |
| SCHEMBL13848441 | 0.77 | STAT3 (0.57) | L3MBTL1 | |
| SCHEMBL2737229 | 0.75 | L3MBTL1 (0.67) | MRGPRX1PGAM1TSPOL3MBTL1 | |
| SCHEMBL4068635 | 0.75 | PTGES2 (0.46) | MRGPRX1CYP17A1LPAR1 |
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 |