Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC2 | O75106 | 5/20 | 0.56 |
| ▸ | AOC3 | Q16853 | 6/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.51 |
| ▸ | DAO | P14920 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL21780142 | 1.00 | AOC2 (0.56) | AOC2AOC3MAPTGAATDP1 | |
| Trifluoroacetic Acid SCHEMBL30089516 | 0.94 | AOC3 (0.52) | AOC2AOC3MAPTGAATDP1 | |
| Trifluoroacetic Acid SCHEMBL21768159 | 0.94 | AOC3 (0.52) | AOC2AOC3MAPTGAATDP1 | |
| Trifluoroacetic Acid SCHEMBL21768080 | 0.94 | AOC3 (0.52) | AOC2AOC3MAPTGAATDP1 | |
| Trifluoroacetic Acid SCHEMBL21768084 | 0.94 | AOC3 (0.52) | AOC2AOC3MAPTGAATDP1 | |
| SCHEMBL21780087 | 0.85 | AOC3 (0.52) | AOC2AOC3MAOAMAOBCA1 | |
| SCHEMBL21780093 | 0.85 | HPGD (0.50) | AOC3CA1CA2CA7CA9 | |
| SCHEMBL21780098 | 0.85 | HPGD (0.50) | AOC3CA1CA2CA7CA9 | |
| Trifluoroacetic Acid SCHEMBL21768076 | 0.82 | AOC3 (0.51) | AOC2AOC3MAOAMAOBCA1 | |
| SCHEMBL21780130 | 0.82 | KMT2A (0.47) | MAPTGAATDP1L3MBTL1TAAR1 |
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 |