Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.47 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | TDP2 | O95551 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4068175 | 0.91 | P2RX3 (0.47) | P2RX3P2RX2PTGS2PTGS1CD274 | |
| SCHEMBL4061388 | 0.85 | P2RX3 (0.46) | P2RX3P2RX2PTGS2PTGS1 | |
| SCHEMBL4061598 | 0.84 | P2RX3 (0.62) | P2RX3P2RX2ARPDGFRBPDGFRA | |
| SCHEMBL10094432 | 0.80 | PTGS2 (0.46) | PTGS2PTGS1CD274MEN1NPC1 | |
| SCHEMBL4072687 | 0.79 | HSD17B10 (0.48) | P2RX3P2RX2CD274MEN1NPC1 | |
| SCHEMBL4060460 | 0.78 | P2RX3 (0.46) | P2RX3P2RX2 | |
| SCHEMBL23666032 | 0.77 | GAA (0.48) | P2RX3P2RX2MEN1ALDH1A1RAB9A | |
| SCHEMBL27316536 | 0.77 | P2RX3 (0.53) | P2RX3P2RX2 | |
| SCHEMBL13848420 | 0.76 | ROCK1 (0.43) | P2RX3P2RX2NPC1ALDH1A1RAB9A | |
| SCHEMBL9464193 | 0.75 | CYP17A1 (0.61) | PTGS2PTGS1MEN1NPC1ALDH1A1 |
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 |