Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 10/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | PPARG | P37231 | 9/20 | 0.47 |
| ▸ | FABP2 | P12104 | 1/20 | 0.47 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL82057 | 0.84 | MTNR1A (0.45) | CYP1A2CYP2C19MEN1KMT2ACYP2D6 | |
| SCHEMBL29444639 | 0.79 | PPARA (0.50) | PPARACYP3A4CYP1A2CYP2C19MEN1 | |
| Dalapon SCHEMBL8386965 | 0.77 | CYP1A2 (0.54) | PPARACYP3A4CYP1A2CYP2C19MEN1 | |
| SCHEMBL117259 | 0.74 | CYP1A2 (0.65) | PPARACYP1A2CYP2C19PPARGGAA | |
| SCHEMBL2399722 | 0.74 | CYP1A2 (0.65) | PPARACYP1A2CYP2C19PPARGGAA | |
| SCHEMBL607372 | 0.74 | CYP1A2 (0.65) | PPARACYP1A2CYP2C19PPARGGAA | |
| SCHEMBL10001177 | 0.74 | CYP1A2 (0.53) | PPARACYP3A4CYP1A2CYP2C19MEN1 | |
| SCHEMBL21057175 | 0.73 | PPARG (0.53) | PPARACYP1A2CYP2C19PPARGCYP2C9 | |
| SCHEMBL20591019 | 0.73 | CYP1A2 (0.62) | PPARACYP1A2CYP2C19PPARGGAA | |
| Hydrochloric Acid SCHEMBL11632943 | 0.73 | CYP1A2 (0.62) | PPARACYP1A2CYP2C19PPARGGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-114149341-B | Aryloxy cyclohexyl amide AMPK agonist, and preparation method and medical application thereof | 中国药科大学 | 2023-07-21 | — | — | CN | disclosed |
| CN-114149341-A | Aryloxy cyclohexyl amide AMPK agonist and preparation method and medical application thereof | 中国药科大学 | 2022-03-08 | — | — | CN | disclosed |