Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 5/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8797444 | 0.80 | NOS3 (0.48) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL8797441 | 0.80 | MAPK1 (0.63) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL8797161 | 0.79 | MAPK1 (0.46) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL8797859 | 0.78 | MAPK1 (0.45) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL7797450 | 0.71 | NOS3 (0.53) | MAPK1ALDH1A1TP53NOS3NOS2 | |
| SCHEMBL8347190 | 0.69 | KDM4E (0.63) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL12182431 | 0.68 | MAPK1 (0.65) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL8345724 | 0.68 | NOS3 (0.59) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL6508707 | 0.67 | KMT2A (0.60) | MAPK1CYP1A2CYP3A4ALDH1A1LMNA | |
| SCHEMBL23482212 | 0.67 | GAA (0.56) | MAPK1CYP1A2ALDH1A1TP53NOS3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0632026-B1 | Alpha amino acid derivatives, a method for their preparation and pharmaceutical preparations containing them | ADIR (FR) | 1997-11-19 | — | — | EP | claimed |
| EP-0632026-B1 | Alpha amino acid derivatives, a method for their preparation and pharmaceutical preparations containing them | ADIR (FR) | 1997-11-19 | — | — | EP | disclosed |
| EP-0632026-A1 | Alpha amino acid derivatives, a method for their preparation and pharmaceutical preparations containing them | ADIR ET COMPAGNIE (FR) | 1995-01-04 | — | — | EP | disclosed |