Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30800013 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HSD17B10ALOX15TSHRMAPK1 | |
| SCHEMBL30799906 | 0.86 | LYN (0.40) | ALDH1A1HSD17B10ALOX15TSHRMAPK1 | |
| SCHEMBL29128447 | 0.86 | LYN (0.40) | ALDH1A1HSD17B10ALOX15TSHRMAPK1 | |
| SCHEMBL30799855 | 0.81 | MTNR1B (0.31) | — | |
| SCHEMBL29128494 | 0.81 | MTNR1B (0.31) | — | |
| SCHEMBL29128462 | 0.80 | POLB (0.36) | ALDH1A1L3MBTL1POLBGFERKDM4E | |
| SCHEMBL30800061 | 0.80 | POLB (0.36) | ALDH1A1L3MBTL1POLBGFERKDM4E | |
| SCHEMBL29128227 | 0.77 | DRD2 (0.33) | ALDH1A1TSHRMAPK1DRD2DRD4 | |
| SCHEMBL30800003 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HSD17B10ALOX15TSHRMAPK1 | |
| SCHEMBL29128262 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HSD17B10ALOX15TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117263862-A | Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof | 吉首大学 | 2023-12-22 | — | — | CN | disclosed |