Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.54 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | 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 | 5/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.52 |
| ▸ | TLR2 | O60603 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | FABP4 | P15090 | 2/20 | 0.52 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.52 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Octanedioate SCHEMBL27798176 | 0.94 | ALDH1A1 (0.59) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Octanedioate SCHEMBL27529964 | 0.94 | ALDH1A1 (0.59) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Sebacic Acid SCHEMBL28110339 | 0.94 | ALDH1A1 (0.59) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Undecanoate SCHEMBL28945595 | 0.88 | GPR84 (0.71) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Alanine SCHEMBL15656769 | 0.82 | TSHR (0.60) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Sebacic Acid SCHEMBL15655096 | 0.82 | TSHR (0.60) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Alanine SCHEMBL28198684 | 0.82 | TSHR (0.60) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Azelaic Acid SCHEMBL29465682 | 0.82 | TSHR (0.67) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Octanoic Acid SCHEMBL29950726 | 0.82 | GPR84 (0.68) | GPR84FFAR1FFAR4ALDH1A1PPARG | |
| Adipic Acid SCHEMBL11438883 | 0.80 | GPR84 (0.54) | GPR84FFAR1FFAR4ALDH1A1PPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106024390-A | Preparation method of 2-butyl ammonium sebate glycol electrolyte solution | 常州工程职业技术学院 | 2016-10-12 | — | — | CN | claimed |
| CN-106024390-A | Preparation method of 2-butyl ammonium sebate glycol electrolyte solution | 常州工程职业技术学院 | 2016-10-12 | — | — | CN | disclosed |