Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | PPARG | P37231 | 5/20 | 0.62 |
| ▸ | F7 | P08709 | 4/20 | 0.62 |
| ▸ | F3 | P13726 | 4/20 | 0.62 |
| ▸ | PPARD | Q03181 | 4/20 | 0.62 |
| ▸ | PPARA | Q07869 | 4/20 | 0.62 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.62 |
| ▸ | FABP4 | P15090 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.62 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| Myristic Acid SCHEMBL28405674 | 0.90 | CYP1A2 (0.54) | ALDH1A1CYP19A1TSHRFAAHCES1 | |
| Palmitic Acid SCHEMBL28405218 | 0.90 | CYP1A2 (0.54) | ALDH1A1CYP19A1TSHRFAAHCES1 | |
| Stearic Acid SCHEMBL28405672 | 0.90 | CYP1A2 (0.54) | ALDH1A1CYP19A1TSHRFAAHCES1 | |
| Ethyl Oleate SCHEMBL28405699 | 0.85 | FAAH (0.57) | ALDH1A1ALOX15HSD17B10CYP3A4TDP1 | |
| Linoleic Acid SCHEMBL27712189 | 0.83 | PPARG (0.62) | ALDH1A1PPARGF7F3PPARD | |
| Oleic Acid SCHEMBL11575690 | 0.83 | PPARG (0.74) | ALDH1A1PPARGF7F3PPARD | |
| Oleic Acid SCHEMBL11575692 | 0.83 | PPARG (0.74) | ALDH1A1PPARGF7F3PPARD | |
| Stearic Acid SCHEMBL2050045 | 0.82 | GPR84 (0.53) | ALDH1A1PPARGPPARDPPARAFFAR1 | |
| Stearic Acid SCHEMBL2049195 | 0.82 | GPR84 (0.53) | ALDH1A1PPARGPPARDPPARAFFAR1 | |
| Adipic Acid SCHEMBL28890670 | 0.82 | LTB4R (0.52) | ALDH1A1FFAR1CES1L3MBTL1 |
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-111097050-A | Composition comprising fatty acid or derivative thereof and phenylpyridine derivative | 黄泳华 | 2020-05-05 | — | — | CN | disclosed |