Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29832058 | 0.86 | CES2 (0.44) | CES2CES1LMNAHSD17B10ALDH1A1 | |
| SCHEMBL29832525 | 0.81 | L3MBTL1 (0.52) | CES2CES1LMNAHSD17B10NPSR1 | |
| SCHEMBL29832283 | 0.77 | CES2 (0.41) | CES2CES1LMNAHSD17B10NPSR1 | |
| SCHEMBL9057035 | 0.75 | CES2 (0.61) | CES2CES1LMNANPSR1ALDH1A1 | |
| SCHEMBL22323002 | 0.72 | CYP2C19 (0.53) | LMNAALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL29832356 | 0.72 | NTSR1 (0.49) | CES2CES1LMNAHSD17B10ALDH1A1 | |
| SCHEMBL31561616 | 0.72 | CES2 (0.51) | CES2CES1LMNAHSD17B10ALDH1A1 | |
| SCHEMBL7580361 | 0.70 | L3MBTL1 (0.59) | CES2CES1LMNAHSD17B10NPSR1 | |
| SCHEMBL29831909 | 0.70 | CES2 (0.46) | CES2CES1NPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22322995 | 0.70 | EPHX1 (0.59) | LMNANPSR1SMN1; SMN2MAPK1 |
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-115093367-A | Preparation method and application of fluoroalkyl ketone compound | 华南农业大学 | 2022-09-23 | — | — | CN | disclosed |