Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | MLYCD | O95822 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8026762 | 0.93 | ALDH1A1 (0.47) | MLYCDFFAR1ALDH1A1NOX1MAOB | |
| SCHEMBL8010485 | 0.89 | ALDH1A1 (0.50) | MLYCDFFAR1ALDH1A1NOX1MAOB | |
| SCHEMBL8020571 | 0.88 | ALDH1A1 (0.51) | MLYCDALDH1A1NOX1MAOBPTPN1 | |
| SCHEMBL8010570 | 0.87 | ALDH1A1 (0.48) | MLYCDFFAR1ALDH1A1MAOBPTPN1 | |
| SCHEMBL8020417 | 0.85 | ALDH1A1 (0.46) | MLYCDFFAR1ALDH1A1MAOBPTPN1 | |
| SCHEMBL8026201 | 0.84 | ALDH1A1 (0.46) | ALDH1A1MAOBPTPN1 | |
| SCHEMBL8024569 | 0.84 | MLYCD (0.45) | MLYCDALDH1A1 | |
| SCHEMBL8010401 | 0.84 | ALDH1A1 (0.45) | ALDH1A1NOX1LTA4HMAOBPTPN1 | |
| SCHEMBL8021208 | 0.83 | ALDH1A1 (0.46) | MLYCDALDH1A1NOX1MAOBPTPN1 | |
| SCHEMBL8024218 | 0.83 | ALDH1A1 (0.44) | MLYCDFFAR1ALDH1A1MAOBPTPN1 |
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 |