Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14842579 | 0.80 | CNR2 (0.40) | AKR1C1SLC6A2SLC6A4OPRM1 | |
| SCHEMBL1958981 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL12276561 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL1955880 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL1958572 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL1958752 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL1954906 | 0.74 | SLC18A3 (0.47) | AKR1C1 | |
| SCHEMBL9295240 | 0.72 | KDM1A (0.44) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23926244 | 0.72 | CHRM3 (0.33) | SLC6A2SLC6A4OPRM1CHRM3 | |
| SCHEMBL23198926 | 0.71 | AKR1C1 (0.39) | AKR1C1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2352715-A1 | PROCESS FOR PRODUCING PHENOL | Exxonmobil Chemical Company (US) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010042261-A1 | PROCESS FOR PRODUCING PHENOL | EXXONMOBIL CHEMICAL COMPANY (US) | 2010-04-15 | — | — | WO | disclosed |