Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL28558904 | 1.00 | LDHA (0.49) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28549393 | 0.84 | LDHA (0.56) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28552846 | 0.81 | LDHA (0.43) | LDHAPPARGPPARAACACBALDH1A1 | |
| SCHEMBL28912154 | 0.80 | LDHA (0.51) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28912156 | 0.80 | LDHA (0.51) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28570416 | 0.79 | SMN1; SMN2 (0.50) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28570415 | 0.79 | SMN1; SMN2 (0.50) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL4040112 | 0.78 | LDHA (0.56) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28558423 | 0.77 | LDHA (0.48) | LDHAPPARGPPARASLC6A4CYP2C19 | |
| SCHEMBL28558424 | 0.77 | LDHA (0.48) | LDHAPPARGPPARASLC6A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107848962-B | Urea derivative or pharmacologically acceptable salt thereof | 杏林制药株式会社 | 2021-04-09 | — | — | CN | disclosed |