Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.61 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.52 |
| ▸ | PPARG | P37231 | 7/20 | 0.52 |
| ▸ | PPARD | Q03181 | 7/20 | 0.52 |
| ▸ | PPARA | Q07869 | 7/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TLR2 | O60603 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | FABP4 | P15090 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.52 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL810202 | 0.84 | — | — | |
| Valeric Acid SCHEMBL31374686 | 0.83 | AKR1B1 (0.58) | CES2AKR1B1GPR84PPARGPPARD | |
| Valeric Acid SCHEMBL1616799 | 0.82 | — | — | |
| Valeric Acid SCHEMBL871383 | 0.79 | FFAR3 (0.77) | CES2AKR1B1GPR84PPARGPPARD | |
| Valeric Acid SCHEMBL3905071 | 0.79 | FFAR3 (0.77) | CES2AKR1B1GPR84PPARGPPARD | |
| Valeric Acid SCHEMBL3901514 | 0.79 | FFAR3 (0.77) | CES2AKR1B1GPR84PPARGPPARD | |
| Valeric Acid SCHEMBL8058164 | 0.79 | FFAR3 (0.77) | CES2AKR1B1GPR84PPARGPPARD | |
| Valeric Acid SCHEMBL1331662 | 0.79 | — | — | |
| Valeric Acid SCHEMBL30442925 | 0.79 | — | — | |
| Valeric Acid SCHEMBL1333240 | 0.79 | — | — |
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-108289831-B | Drug delivery compositions containing silyl polymers | 海伦特医药有限公司 | 2021-11-19 | — | — | CN | disclosed |