Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC2 | O75106 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CPT2 | P23786 | 1/20 | 0.38 |
| ▸ | CPT1A | P50416 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21780057 | 1.00 | AOC2 (0.41) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL30089527 | 0.95 | AOC2 (0.38) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL21768123 | 0.95 | AOC2 (0.38) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL30089532 | 0.95 | AOC2 (0.38) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL21768136 | 0.95 | AOC2 (0.38) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL21768048 | 0.95 | AOC2 (0.38) | AOC2NPC1TRAP1ALDH1A1HPGD | |
| SCHEMBL21780098 | 0.87 | HPGD (0.50) | NPC1ALDH1A1HPGDSMN1; SMN2AOC3 | |
| SCHEMBL21780093 | 0.87 | HPGD (0.50) | NPC1ALDH1A1HPGDSMN1; SMN2AOC3 | |
| Trifluoroacetic Acid SCHEMBL30089447 | 0.83 | HPGD (0.45) | NPC1ALDH1A1HPGDSMN1; SMN2AOC3 | |
| Trifluoroacetic Acid SCHEMBL30089487 | 0.83 | HPGD (0.45) | NPC1ALDH1A1HPGDSMN1; SMN2AOC3 |
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 |