Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 1.00 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.94 |
| ▸ | PPARG | P37231 | 7/20 | 0.94 |
| ▸ | PPARD | Q03181 | 7/20 | 0.94 |
| ▸ | PPARA | Q07869 | 7/20 | 0.94 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.94 |
| ▸ | TSHR | P16473 | 4/20 | 0.94 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.94 |
| ▸ | FABP4 | P15090 | 3/20 | 0.94 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.94 |
| ▸ | TLR2 | O60603 | 2/20 | 0.94 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.94 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.94 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.94 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.94 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.94 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.94 |
| ▸ | MEN1 | O00255 | 1/20 | 0.94 |
| ▸ | ESR1 | P03372 | 1/20 | 0.94 |
| ▸ | PDE4A | P27815 | 1/20 | 0.94 |
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 | |
|---|---|---|---|---|
| Hexanoate SCHEMBL3867 | 1.00 | — | — | |
| Adipic Acid SCHEMBL31546519 | 1.00 | AKR1B1 (1.00) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL160301 | 1.00 | AKR1B1 (1.00) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL1330703 | 1.00 | — | — | |
| Hexanoate SCHEMBL1332504 | 1.00 | — | — | |
| Hexanoate SCHEMBL4619316 | 1.00 | AKR1B1 (1.00) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL27362881 | 1.00 | AKR1B1 (1.00) | AKR1B1GPR84PPARGPPARDPPARA | |
| Adipic Acid SCHEMBL2065667 | 1.00 | AKR1B1 (1.00) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL29695652 | 1.00 | — | — | |
| Dodecanoate SCHEMBL25293218 | 0.97 | GPR84 (1.00) | AKR1B1GPR84PPARGPPARDPPARA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104725553-B | A kind of composite and its application for being used to prepare intraocular lens | 北京艾克伦医疗科技有限公司 | 2018-01-16 | — | — | CN | claimed |
| CN-117242037-A | Separation method | 欧佩克修复技术有限公司 | 2023-12-15 | — | — | CN | disclosed |
| CN-117241784-A | Specific combinations of lipids and methods and uses related thereto | 赫尔辛基大学 | 2023-12-15 | — | — | CN | disclosed |