Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.70 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | NQO2 | P16083 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | AHR | P35869 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | FBP1 | P09467 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22398154 | 1.00 | NFE2L2 (0.70) | NFE2L2RELANQO2PTGS1AHR | |
| SCHEMBL22398153 | 1.00 | NFE2L2 (0.70) | NFE2L2RELANQO2PTGS1AHR | |
| SCHEMBL13874966 | 0.91 | NFE2L2 (0.84) | NFE2L2RELAPTGS1ALOX5PTGS2 | |
| SCHEMBL1179749 | 0.84 | RELA (0.74) | NFE2L2RELAPTGS1ALOX5PTGS2 | |
| SCHEMBL29673932 | 0.84 | RELA (0.74) | NFE2L2RELAPTGS1ALOX5PTGS2 | |
| SCHEMBL1179750 | 0.84 | RELA (0.74) | NFE2L2RELAPTGS1ALOX5PTGS2 | |
| SCHEMBL17083047 | 0.82 | NFE2L2 (1.00) | NFE2L2FBP1 | |
| SCHEMBL13799367 | 0.81 | NFE2L2 (0.67) | NFE2L2RELANQO2PTGS1AHR | |
| SCHEMBL13799369 | 0.81 | NFE2L2 (0.67) | NFE2L2RELANQO2PTGS1AHR | |
| SCHEMBL13906334 | 0.81 | NFE2L2 (0.67) | NFE2L2RELANQO2PTGS1AHR |
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-111886234-B | Heterocyclic mitochondrial activity inhibitors and uses thereof | 蒙特利尔大学 | 2023-12-15 | — | — | CN | disclosed |