Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL701570 | 0.84 | CES1 (0.55) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL28959800 | 0.83 | CES1 (0.47) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL338172 | 0.82 | CES1 (0.55) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL28576924 | 0.80 | CES1 (0.53) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL4264384 | 0.79 | CES1 (0.50) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL7243627 | 0.78 | CES1 (0.52) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL28376294 | 0.77 | HPRT1 (0.58) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL4600511 | 0.77 | CES1 (0.48) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL33523810 | 0.76 | CES1 (0.42) | CES1ALDH1A1HSD17B10HPGDHIF1A | |
| SCHEMBL29202921 | 0.76 | CES1 (0.42) | CES1ALDH1A1HSD17B10HPGDHIF1A |
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-115246858-A | Phosphine-oxa bidentate ligand and its coordinated transition metal complex and use | 东莞市均成高新材料有限公司 | 2022-10-28 | — | — | CN | disclosed |