Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.61 |
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.58 |
| ▸ | PPARG | P37231 | 7/20 | 0.58 |
| ▸ | PPARD | Q03181 | 7/20 | 0.58 |
| ▸ | PPARA | Q07869 | 7/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.58 |
| ▸ | TSHR | P16473 | 5/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | TLR2 | O60603 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | FABP4 | P15090 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.58 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.58 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.58 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| Valeric Acid SCHEMBL27773247 | 0.93 | AKR1B1 (0.70) | AKR1B1GPR84PPARGPPARDPPARA | |
| Valeric Acid SCHEMBL183187 | 0.93 | AKR1B1 (0.70) | AKR1B1GPR84PPARGPPARDPPARA | |
| Valeric Acid SCHEMBL49002 | 0.87 | AKR1B1 (0.70) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL4970439 | 0.85 | AKR1B1 (0.84) | AKR1B1GPR84PPARGPPARDPPARA | |
| Adipic Acid SCHEMBL7106977 | 0.85 | AKR1B1 (0.84) | AKR1B1GPR84PPARGPPARDPPARA | |
| Valeric Acid SCHEMBL3432837 | 0.85 | CAMK2A (0.74) | AKR1B1GPR84PPARGPPARDPPARA | |
| Valeric Acid SCHEMBL4214226 | 0.85 | AKR1B1 (0.67) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL350667 | 0.85 | AKR1B1 (0.84) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL2929839 | 0.85 | AKR1B1 (0.84) | AKR1B1GPR84PPARGPPARDPPARA | |
| Hexanoate SCHEMBL1838241 | 0.85 | AKR1B1 (0.84) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2023131530-A1 | A CLEANING COMPOSITION FOR METAL SUBSTRATES PRETREATMENT AND ITS PREPARATION METHOD AND APPLICATION THEREOF | BASF COATINGS GMBH (DE) | 2023-07-13 | — | — | WO | disclosed |
| CN-102176821-A | Liquid aqueous crop protection formulations | BASF SE | 2011-09-07 | — | — | CN | disclosed |
| CN-102176820-A | Liquid crop protection formulations containing pyraclostrobin | BASF SE | 2011-09-07 | — | — | CN | disclosed |