Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17207531 | 0.84 | AOC3 (0.50) | AOC3RAB9ANPC1LMNAXDH | |
| SCHEMBL31327475 | 0.82 | AOC3 (0.52) | AOC3RAB9ANPC1XDHKIF11 | |
| SCHEMBL15299217 | 0.82 | AOC3 (0.52) | AOC3RAB9ANPC1XDHKDM4E | |
| SCHEMBL11642290 | 0.81 | NR1H2 (0.55) | AOC3RAB9ANPC1LMNAXDH | |
| SCHEMBL16599546 | 0.80 | NPC1 (0.47) | AOC3RAB9ANPC1LMNAXDH | |
| SCHEMBL16328874 | 0.79 | AOC3 (0.50) | AOC3RAB9ANPC1XDHDGAT1 | |
| Hydrochloric Acid SCHEMBL9573625 | 0.79 | ATAD2 (0.57) | AOC3RAB9ANPC1LMNAMAPT | |
| SCHEMBL26464405 | 0.77 | NPC1 (0.67) | RAB9ANPC1LMNAKIF11MAPT | |
| SCHEMBL1832874 | 0.76 | ABCC8 (0.52) | AOC3RAB9ANPC1LMNAXDH | |
| SCHEMBL7512048 | 0.75 | AOC3 (0.40) | AOC3RAB9AXDHMAPTKDM4E |
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-2019171234-A1 | HETEROCYCLIC COMPOUNDS AS FUNGICIDES | PI INDUSTRIES LTD. (IN) | 2019-09-12 | — | — | WO | disclosed |