Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.44 |
| ▸ | CES1 | P23141 | 4/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.43 |
| ▸ | PPARG | P37231 | 7/20 | 0.43 |
| ▸ | PPARD | Q03181 | 7/20 | 0.43 |
| ▸ | PPARA | Q07869 | 7/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31647623 | 0.91 | CES2 (0.48) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL16012600 | 0.91 | CES2 (0.48) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL16012618 | 0.91 | CES2 (0.48) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL4136048 | 0.91 | CES1 (0.40) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL1701354 | 0.89 | CES2 (0.46) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL1701125 | 0.89 | CES2 (0.46) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL6627036 | 0.89 | TRPA1 (0.48) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL28274695 | 0.83 | CES2 (0.41) | CES2CES1TRPA1GPR84PPARG | |
| SCHEMBL19976119 | 0.81 | — | — | |
| SCHEMBL20942865 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1328506-B1 | INTERMEDIATES FOR USE IN RETINOID SYNTHESIS | CENTRE NAT RECH SCIENT (FR) | 2004-12-29 | — | — | EP | disclosed |