Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8372438 | 0.81 | CES2 (0.52) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL8373612 | 0.81 | CES2 (0.52) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL31204160 | 0.79 | CES2 (0.50) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL29692098 | 0.79 | CES2 (0.50) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL8778837 | 0.79 | CES2 (0.50) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL1314838 | 0.79 | CES2 (0.50) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL1314837 | 0.79 | CES2 (0.50) | CES2CES1ALDH1A1POLBKDM4E | |
| SCHEMBL5201137 | 0.76 | MAOA (0.39) | POLBHPGDRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL5201132 | 0.76 | MAOA (0.39) | POLBHPGDRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL15053330 | 0.76 | ALDH1A1 (0.56) | CES2CES1ALDH1A1POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0036711-A2 | Pesticidal heterocyclic compounds, processes for preparing them, compositions containing them, and their use | FBC LIMITED (GB) | 1981-09-30 | — | — | EP | disclosed |