Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL7454235 | 1.00 | SMN1; SMN2 (0.44) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL7454241 | 1.00 | SMN1; SMN2 (0.44) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL11795879 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL722642 | 0.82 | CYP2D6 (0.48) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL17491377 | 0.82 | SMN1; SMN2 (0.48) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL28764503 | 0.79 | ALDH1A1 (0.51) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL286761 | 0.79 | CYP2D6 (0.48) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL418307 | 0.78 | ALDH1A1 (0.69) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL22355972 | 0.76 | KMT2A (0.56) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 | |
| SCHEMBL22356140 | 0.76 | KMT2A (0.56) | SMN1; SMN2CYP2D6CYP1A2PKMNPSR1 |
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-0930292-B1 | PROCESS FOR PREPARING BETA-AMINO-ALPHA-HYDROXY ACID DERIVATIVES | KANEKA CORP (JP) | 2002-10-16 | — | — | EP | claimed |