Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 9/20 | 0.65 |
| ▸ | PPARA | Q07869 | 9/20 | 0.65 |
| ▸ | PPARD | Q03181 | 2/20 | 0.60 |
| ▸ | CTSK | P43235 | 4/20 | 0.53 |
| ▸ | TLR2 | O60603 | 1/20 | 0.51 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28437812 | 0.90 | PPARA (0.64) | PPARGPPARAPPARDCTSKTLR2 | |
| SCHEMBL28435611 | 0.89 | PPARA (0.63) | PPARGPPARAPPARDCTSKTLR2 | |
| SCHEMBL14632961 | 0.86 | CTSK (0.59) | CTSKBCHEACHE | |
| SCHEMBL8271187 | 0.86 | CTSK (0.59) | CTSKBCHEACHE | |
| SCHEMBL28438702 | 0.86 | PPARA (0.59) | PPARGPPARAPPARDCTSKTLR2 | |
| SCHEMBL10937517 | 0.84 | PPARA (0.61) | PPARGPPARAPPARDCTSK | |
| SCHEMBL3362562 | 0.83 | PPARA (0.90) | PPARGPPARAPPARD | |
| SCHEMBL3582418 | 0.83 | PPARA (0.90) | PPARGPPARAPPARD | |
| SCHEMBL5853138 | 0.83 | PPARA (0.90) | PPARGPPARAPPARD | |
| SCHEMBL8316313 | 0.83 | PPARA (0.67) | PPARGPPARAPPARDCTSKCYP1A2 |
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-111484413-A | Danshensu and H2S/NO donor conjugate, preparation method thereof and application thereof in pharmacy | 复旦大学 | 2020-08-04 | — | — | CN | disclosed |