Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 9/20 | 0.36 |
| ▸ | PPARA | Q07869 | 9/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL19836373 | 0.84 | ALDH1A1 (0.33) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21918282 | 0.83 | ACHE (0.32) | — | |
| SCHEMBL20967930 | 0.83 | ALDH1A1 (0.36) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19311818 | 0.78 | ALDH1A1 (0.36) | CYP3A4 | |
| SCHEMBL19650761 | 0.78 | CYP2C9 (0.36) | PPARGPPARACYP2C9CYP2C19PPARD | |
| SCHEMBL16385594 | 0.78 | CA12 (0.47) | PPARGPPARACYP2C9CYP2C19PPARD | |
| SCHEMBL29453916 | 0.78 | CA12 (0.47) | PPARGPPARACYP2C9CYP2C19PPARD | |
| SCHEMBL18400709 | 0.78 | NPSR1 (0.38) | — | |
| SCHEMBL25912759 | 0.77 | CA12 (0.41) | PPARGPPARACYP2C9CYP2C19PPARD | |
| SCHEMBL13271473 | 0.77 | TRPM8 (0.40) | CYP2C9CYP2C19CYP1A2HDAC8HDAC6 |
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-3163644-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | Hodogaya Chemical Co., Ltd. (JP) | 2017-05-03 | — | — | EP | disclosed |