Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21021729 | 0.90 | AHR (0.51) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL21022299 | 0.89 | PTGS1 (0.53) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL21021168 | 0.84 | AHR (0.63) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL12603780 | 0.80 | PTGS1 (0.52) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL21021774 | 0.80 | ALOX5 (0.50) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL18144159 | 0.79 | AHR (0.71) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL18144154 | 0.79 | AHR (0.71) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL30739715 | 0.79 | AHR (0.71) | AHRPTGS1ALOX5PTGS2TUBB1 | |
| SCHEMBL21021188 | 0.78 | NFE2L2 (0.69) | PTGS1ALOX5PTGS2NFE2L2MAOA | |
| SCHEMBL21020531 | 0.78 | ALOX5 (0.56) | AHRPTGS1ALOX5PTGS2TUBB1 |
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-2018071327-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2018-04-19 | — | — | WO | disclosed |