Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL257116 | 0.86 | AHR (0.36) | AHRTYMPPTGS1PTGS2 | |
| SCHEMBL17655770 | 0.86 | TP53 (0.44) | AHRTYMPALDH1A1 | |
| SCHEMBL13772832 | 0.86 | AHR (0.36) | AHRTYMPIDO1ALOX5PTGS1 | |
| SCHEMBL257120 | 0.86 | AHR (0.36) | AHRTYMP | |
| SCHEMBL28015714 | 0.82 | AHR (0.45) | AHRTSHRTYMPKCNH2 | |
| SCHEMBL256046 | 0.81 | AHR (0.50) | AHR | |
| SCHEMBL28197282 | 0.79 | ALDH1A1 (0.36) | AHRTYMPALDH1A1 | |
| SCHEMBL28015089 | 0.79 | AHR (0.42) | AHRKCNH2 | |
| SCHEMBL9131505 | 0.79 | CHAT (0.53) | — | |
| SCHEMBL256033 | 0.79 | CHAT (0.53) | — |
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-2012028578-A1 | SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES | BAYER CROPSCIENCE AG (DE) | 2012-03-08 | — | — | WO | disclosed |