Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.44 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21780053 | 0.91 | AOC3 (0.48) | AOC3MAOBKMT2ANPC1MEN1 | |
| SCHEMBL21768045 | 0.86 | ALDH1A1 (0.49) | AOC3MAOBKMT2ANPC1MEN1 | |
| SCHEMBL21768044 | 0.86 | ALDH1A1 (0.49) | AOC3MAOBKMT2ANPC1MEN1 | |
| SCHEMBL23718599 | 0.86 | AOC3 (0.50) | AOC3MAOBMAPK1 | |
| SCHEMBL21768043 | 0.86 | AOC3 (0.50) | AOC3MAOBMAPK1 | |
| SCHEMBL21780054 | 0.86 | AOC3 (0.50) | AOC3MAOBMAPK1 | |
| SCHEMBL21780044 | 0.83 | AOC3 (0.49) | AOC3MAOBNPC1RAB9AALDH1A1 | |
| SCHEMBL21768135 | 0.83 | AOC3 (0.49) | AOC3MAOBNPC1RAB9AALDH1A1 | |
| SCHEMBL23718635 | 0.83 | AOC3 (0.49) | AOC3MAOBNPC1RAB9AALDH1A1 | |
| SCHEMBL23718801 | 0.82 | KMT2A (0.43) | AOC3MAOBKMT2AMEN1ALDH1A1 |
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-3617186-A1 | FLUOROALLYLAMINE DERIVATIVE AND USE THEREOF | Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) | 2020-03-04 | — | — | EP | disclosed |