Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | OXER1 | Q8TDS5 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | F7 | P08709 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | F3 | P13726 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PPARD | Q03181 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11845230 | 1.00 | TRPA1 (0.38) | TRPA1PPARAOXER1ALDH1A1CYP19A1 | |
| SCHEMBL28978612 | 0.90 | PPARA (0.41) | TRPA1PPARAOXER1ALDH1A1CYP19A1 | |
| SCHEMBL21484057 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA | |
| SCHEMBL3387971 | 0.86 | — | — | |
| SCHEMBL10910041 | 0.86 | — | — | |
| SCHEMBL1551787 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA | |
| SCHEMBL21679678 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA | |
| SCHEMBL21484058 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA | |
| SCHEMBL21679677 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA | |
| SCHEMBL1611678 | 0.86 | ALDH1A1 (0.41) | PPARAOXER1ALDH1A1CYP19A1RXRA |
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 |
|---|---|---|---|---|---|---|---|
| US-3971825-A | (5,6) (10,11) BIS-METHYLENE, BRONCHODILATORS | SANKYO COMPANY LIMITED (JA) | 1976-07-27 | — | — | US | disclosed |