Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 2/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 4/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | PRCP | P42785 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29005173 | 0.85 | ALDH1A1 (0.54) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL4277192 | 0.79 | S1PR3 (0.53) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL4289099 | 0.79 | S1PR3 (0.53) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL999536 | 0.79 | S1PR3 (0.53) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL6443317 | 0.77 | PPARA (0.48) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL23205818 | 0.76 | PPARG (0.47) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL20521905 | 0.76 | PPARG (0.47) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL3824377 | 0.76 | TRPA1 (0.49) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL5862822 | 0.76 | PPARG (0.47) | S1PR3PPARGPPARAALDH1A1MAPT | |
| SCHEMBL2836398 | 0.76 | TRPA1 (0.52) | S1PR3PPARGPPARAALDH1A1MAPT |
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-116134018-A | 2-oxoimidazolidine-4-carboxamide as NAV1.8 inhibitor | 默沙东有限责任公司 | 2023-05-16 | — | — | CN | disclosed |