Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 7/20 | 0.44 |
| ▸ | FAAH | O00519 | 4/20 | 0.44 |
| ▸ | PLA2G6 | O60733 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 4/20 | 0.38 |
| ▸ | PPARD | Q03181 | 4/20 | 0.38 |
| ▸ | PPARA | Q07869 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3869805 | 1.00 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL22951373 | 1.00 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL22951385 | 1.00 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL22951375 | 1.00 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL3864583 | 0.98 | CES2 (0.42) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL3866692 | 0.91 | NOS3 (0.43) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL9949444 | 0.85 | FAAH (0.56) | CES2HSD17B10CES1FAAHPLA2G6 | |
| SCHEMBL22955375 | 0.83 | CES2 (0.42) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL22956016 | 0.83 | CES2 (0.42) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL3864690 | 0.81 | TDP1 (0.50) | CES1TSHRALDH1A1TDP1 |
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-118637970-A | Method for producing thioester derivative, method for producing ketone derivative, and method for producing aldehyde derivative | 株式会社德山 | 2024-09-13 | — | — | CN | disclosed |