Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8720674 | 1.00 | HTT (0.50) | HTTCES2CES1CA1CA2 | |
| SCHEMBL11491555 | 0.81 | ALDH1A1 (0.50) | HTTCES2CES1MAPTGSK3B | |
| SCHEMBL11491554 | 0.81 | ALDH1A1 (0.50) | HTTCES2CES1MAPTGSK3B | |
| SCHEMBL11032602 | 0.81 | HSD17B1 (0.48) | HTTCES2CA1CA2MAPT | |
| SCHEMBL5742677 | 0.79 | CES2 (0.48) | CES2CES1CA1CA2MAPT | |
| SCHEMBL5742673 | 0.79 | CES2 (0.48) | CES2CES1CA1CA2MAPT | |
| SCHEMBL6839865 | 0.78 | GAA (0.63) | CES2CES1CA1CA2MAPT | |
| SCHEMBL10710889 | 0.78 | GAA (0.63) | CES2CES1CA1CA2MAPT | |
| SCHEMBL6839869 | 0.78 | GAA (0.63) | CES2CES1CA1CA2MAPT | |
| SCHEMBL7691078 | 0.75 | NAPRT (0.46) | HTTCYP2C19CYP1A2CYP3A4KMT2A |
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-1998028262-A1 | O-BENZYL OXIME ETHER DERIVATIVES AS PECTICIDES | NOVARTIS AG (CH) | 1998-07-02 | — | — | WO | disclosed |