Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | PPARA | Q07869 | 3/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 2/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | KLK7 | P49862 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | APLNR | P35414 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28562308 | 0.91 | SCN9A (0.35) | ALDH1A1KDM4ESCN9ALDHAPPARG | |
| SCHEMBL22723020 | 0.87 | LDHA (0.37) | ALDH1A1KDM4ELDHAPPARGPPARA | |
| SCHEMBL22723021 | 0.87 | LDHA (0.37) | ALDH1A1KDM4ELDHAPPARGPPARA | |
| SCHEMBL18262421 | 0.80 | LDHA (0.39) | ALDH1A1KDM4ELDHAACACB | |
| SCHEMBL18262422 | 0.80 | LDHA (0.39) | ALDH1A1KDM4ELDHAACACB | |
| SCHEMBL28558406 | 0.80 | ITGB3 (0.46) | ALDH1A1PPARGPPARALMNA | |
| SCHEMBL20415684 | 0.80 | ITGB3 (0.46) | ALDH1A1PPARGPPARALMNA | |
| SCHEMBL28564659 | 0.79 | LDHA (0.34) | ALDH1A1KDM4ELDHAPPARGPPARA | |
| SCHEMBL28564662 | 0.79 | LDHA (0.34) | ALDH1A1KDM4ELDHAPPARGPPARA | |
| SCHEMBL28552846 | 0.78 | LDHA (0.43) | ALDH1A1SCN9ALDHAPPARGPPARA |
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 |