Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.33 |
| ▸ | GPR183 | P32249 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30632897 | 0.84 | NFE2L2 (0.50) | NFE2L2 | |
| SCHEMBL30633073 | 0.82 | NPC1 (0.36) | NFE2L2GPR183NPC1RAB9APIK3R1 | |
| SCHEMBL28473621 | 0.79 | CYP1A1 (0.37) | NFE2L2ALOX5APFEN1 | |
| SCHEMBL30624911 | 0.78 | CYP1A1 (0.55) | NFE2L2NPC1RAB9AMAPK1CYP1A2 | |
| SCHEMBL30632963 | 0.78 | NFE2L2 (0.55) | NFE2L2NPC1RAB9AGRM4SMN1; SMN2 | |
| SCHEMBL30632881 | 0.76 | CBFB (0.39) | NPC1RAB9AALOX5APFEN1MAPK1 | |
| SCHEMBL30632941 | 0.76 | HTR2A (0.38) | — | |
| SCHEMBL30632879 | 0.76 | ALDH1A1 (0.39) | NPC1RAB9ANTSR1ALDH1A1MAPT | |
| SCHEMBL30632906 | 0.75 | NUDT1 (0.36) | NFE2L2GRM4CYP2C19 | |
| SCHEMBL30632981 | 0.74 | RAB9A (0.43) | NPC1RAB9AALDH1A1MAPTKMT2A |
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 |