Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LNPEP | Q9UIQ6 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | EPOR | P19235 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8020677 | 0.94 | ALDH1A1 (0.43) | ALDH1A1MAOBALOX5EPORPTGES | |
| SCHEMBL8026727 | 0.94 | MRGPRX4 (0.45) | LNPEPSMN1; SMN2ALDH1A1MAOBMRGPRX4 | |
| SCHEMBL8026201 | 0.92 | ALDH1A1 (0.46) | LNPEPMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL8171062 | 0.88 | MLYCD (0.41) | ALDH1A1 | |
| SCHEMBL8026900 | 0.87 | MRGPRX4 (0.46) | LNPEPSMN1; SMN2ALDH1A1MRGPRX4 | |
| SCHEMBL8010485 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAOBALOX5EPOR | |
| SCHEMBL8020308 | 0.86 | MLYCD (0.41) | PTGES | |
| SCHEMBL8020571 | 0.86 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1MAOBEPOR | |
| SCHEMBL8010570 | 0.84 | ALDH1A1 (0.48) | MEN1KMT2AALDH1A1MAOB | |
| SCHEMBL8022286 | 0.84 | MLYCD (0.41) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6156774-A | Beta-thiopropionyl-amino acid derivatives and their use as beta-lactamase inhibitors | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-12-05 | — | — | US | disclosed |