Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30001086 | 0.89 | OPRM1 (0.56) | ACHEOPRM1OPRD1OPRK1XDH | |
| SCHEMBL299759 | 0.89 | OPRM1 (0.56) | ACHEOPRM1OPRD1OPRK1XDH | |
| Phenol SCHEMBL28307830 | 0.88 | ACHE (0.47) | ACHEOPRM1OPRD1OPRK1XDH | |
| SCHEMBL2137377 | 0.85 | TAAR1 (0.50) | ACHEXDHALDH1A1GAAKDM4E | |
| SCHEMBL31481296 | 0.85 | TAAR1 (0.50) | ACHEXDHALDH1A1GAAKDM4E | |
| SCHEMBL28988330 | 0.85 | ALDH1A1 (0.47) | ACHEOPRM1OPRD1OPRK1XDH | |
| Phenol SCHEMBL5932073 | 0.84 | OPRK1 (0.51) | OPRM1OPRD1OPRK1XDHALDH1A1 | |
| Acetic Acid SCHEMBL11403510 | 0.83 | PTGS2 (0.50) | OPRM1OPRD1OPRK1XDHALDH1A1 | |
| Metacresol SCHEMBL10761467 | 0.79 | ACHE (0.77) | ACHEALDH1A1CYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL11209132 | 0.79 | ACHE (0.53) | ACHEOPRM1OPRD1OPRK1XDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0012613-B1 | A PROCESS FOR PRODUCING 3-ALKYLPHENOLS AND 1,3-DIHYDROXYBENZENE | MOBIL OIL CORPORATION (US) | 1984-08-08 | — | — | EP | claimed |