Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PRKCA | P17252 | 2/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
| ▸ | PRKCB | P05771 | 1/20 | 0.33 |
| ▸ | PRKCH | P24723 | 1/20 | 0.33 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.33 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.33 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.33 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22470042 | 0.73 | ALDH1A1 (0.47) | ALDH1A1EPHX1CYP1A2PRKCAPRKD3 | |
| SCHEMBL1119091 | 0.70 | EPHX1 (0.42) | ALDH1A1EPHX1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22471622 | 0.66 | ALDH1A1 (0.42) | ALDH1A1EPHX1CYP1A2PRKCAPRKD3 | |
| SCHEMBL22484611 | 0.66 | ALDH1A1 (0.42) | ALDH1A1EPHX1CYP1A2PRKCAPRKD3 | |
| SCHEMBL22482939 | 0.65 | ALDH1A1 (0.41) | ALDH1A1EPHX1CYP1A2GRM2PPARG | |
| SCHEMBL11229484 | 0.65 | TDP1 (0.38) | PRKCAPRKD3PRKCGPRKCBPRKCH | |
| Acetic Acid SCHEMBL4544293 | 0.62 | EPHX1 (0.50) | ALDH1A1EPHX1CYP1A2ALOX5PPARG | |
| Dodecane SCHEMBL2499543 | 0.60 | ALDH1A1 (0.50) | ALDH1A1PPARG | |
| SCHEMBL17607311 | 0.60 | ALDH1A1 (0.38) | ALDH1A1PPARG | |
| SCHEMBL31362247 | 0.60 | ALDH1A1 (0.55) | ALDH1A1EPHX1CYP1A2GRM2 |
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-2020193650-A1 | PROCESS FOR PREPARING 1,2-ENDOPEROXIDE COMPOUNDS | Universite Paris-Saclay (FR) | 2020-10-01 | — | — | WO | disclosed |
| WO-2020193650-A1 | PROCESS FOR PREPARING 1,2-ENDOPEROXIDE COMPOUNDS | Universite Paris-Saclay (FR) | 2020-10-01 | — | — | WO | disclosed |