Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 2/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | PREP | P48147 | 3/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14728212 | 0.87 | LDHA (0.44) | LDHAPPARGPPARAPREPCA12 | |
| SCHEMBL14728214 | 0.85 | PTPN1 (0.55) | CYP1A2LDHAKMT2A | |
| SCHEMBL9694700 | 0.85 | PTPN1 (0.55) | CYP1A2LDHAKMT2A | |
| SCHEMBL5385209 | 0.84 | PPARG (0.52) | LDHAPPARGPPARA | |
| SCHEMBL22394805 | 0.82 | PPARG (0.45) | LDHAPPARGEPHX2PPARA | |
| SCHEMBL14601773 | 0.81 | ITGB3 (0.55) | MMEPPARGKMT2A | |
| SCHEMBL2506528 | 0.81 | SRD5A2 (0.46) | PREPCA12CA1CA9 | |
| SCHEMBL4266308 | 0.80 | FFAR1 (0.53) | — | |
| SCHEMBL9848630 | 0.80 | PREP (0.40) | MMELDHAPPARGEPHX2PPARA | |
| SCHEMBL13535171 | 0.79 | PREP (0.40) | LDHAPREPCA12CA1CA9 |
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-0438873-A1 | Inhibitor of ribonucleotide reductase of herpes viruses | MERCK & CO. INC. (US) | 1991-07-31 | — | — | EP | disclosed |