Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | RARA | P10276 | 4/20 | 0.39 |
| ▸ | RARB | P10826 | 4/20 | 0.39 |
| ▸ | RARG | P13631 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | CYP26B1 | Q9NR63 | 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 | |
|---|---|---|---|---|
| SCHEMBL7183938 | 0.79 | HNF4A (0.44) | HNF4APTGS1PTGS2RARARARB | |
| SCHEMBL7196169 | 0.77 | PTGS1 (0.42) | HNF4APTGS1PTGS2RARARARB | |
| SCHEMBL7139884 | 0.75 | PTGS2 (0.63) | PTGS1PTGS2 | |
| SCHEMBL7183948 | 0.75 | HNF4A (0.40) | HNF4APTGS1PTGS2MAPTRXRA | |
| SCHEMBL21750733 | 0.74 | HNF4A (0.44) | HNF4AALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL2240683 | 0.70 | RARB (0.64) | HNF4APTGS1PTGS2RARARARB | |
| SCHEMBL8331631 | 0.69 | TSHR (0.41) | HNF4AALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7151868 | 0.69 | TSHR (0.41) | HNF4AALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL11799631 | 0.67 | GPR35 (0.61) | PTGS2RARBMAPK1ALDH1A1MAPT | |
| SCHEMBL11808788 | 0.67 | MAPK1 (0.48) | MAPK1ALDH1A1MAPTMEN1KMT2A |
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-6586460-B1 | Administering heterocyclic ethers or sulfides to induce apoptosis, cell differentiation and as anticarcinogenic agents | THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY | 2003-07-01 | — | — | US | disclosed |