Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7969857 | 0.82 | NFE2L2 (0.49) | CYP1A2MAOBNFE2L2RELAFBP1 | |
| SCHEMBL7972007 | 0.79 | NFE2L2 (0.54) | NPC1CYP1A2NFE2L2RELAFBP1 | |
| SCHEMBL7958743 | 0.76 | NFE2L2 (0.40) | NPC1CYP1A2NFE2L2ALDH1A1RAB9A | |
| SCHEMBL3302772 | 0.74 | TP53 (0.65) | TP53TDP1NPC1CASP3SENP8 | |
| SCHEMBL7971834 | 0.74 | TLR4 (0.42) | PTGS1PTGS2MAOBALOX5NFE2L2 | |
| SCHEMBL7971685 | 0.73 | ALDH1A1 (0.52) | TDP1NPC1CYP1A2NFE2L2FBP1 | |
| SCHEMBL7969643 | 0.73 | NFE2L2 (0.38) | TDP1NPC1NFE2L2ALDH1A1RAB9A | |
| SCHEMBL7969371 | 0.72 | NPC1 (0.45) | TDP1NPC1CYP1A2NFE2L2NFKB1 | |
| SCHEMBL18240555 | 0.72 | TP53 (0.52) | TP53TDP1NPC1CASP3SENP8 | |
| SCHEMBL7958651 | 0.71 | NFE2L2 (0.56) | TP53NPC1CYP1A2NFE2L2RELA |
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-2001017965-A2 | CYANOPIPERIDINES AS PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2001-03-15 | — | — | WO | disclosed |