Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 5/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.42 |
| ▸ | UBE2D3 | P61077 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | STAT6 | P42226 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18334098 | 0.83 | PKM (0.51) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL17147744 | 0.77 | PKM (0.46) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL18334095 | 0.77 | PKM (0.46) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL17147754 | 0.73 | PKM (0.55) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL17147746 | 0.73 | PKM (0.55) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL30463131 | 0.72 | PKM (0.47) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL21527011 | 0.70 | PKM (0.48) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL29660633 | 0.69 | PKM (0.39) | PKMNLRP3UBE2D3ALDH1A1MAPT | |
| SCHEMBL18334077 | 0.66 | PKM (0.40) | PKMNLRP3UBE2D3ALDH1A1LMNA | |
| SCHEMBL29935069 | 0.65 | PKM (0.48) | PKMNLRP3UBE2D3ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023178302-A1 | PARTHENOLIDE DERIVATIVES AND USE THEREOF | UNIVERSITY OF ROCHESTER (US) | 2023-09-21 | — | — | WO | disclosed |