Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 5/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.40 |
| ▸ | PDE6D | O43924 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29967886 | 0.98 | PPARG (0.40) | PPARGP2RX3PDE6DALDH1A1ALDH2 | |
| SCHEMBL29967492 | 0.94 | TP53 (0.39) | PPARGP2RX3PDE6DALDH1A1ALDH2 | |
| SCHEMBL29968184 | 0.91 | PPARG (0.43) | PPARGP2RX3PDE6DALDH1A1ALDH2 | |
| SCHEMBL29967971 | 0.90 | PPARG (0.42) | PPARGP2RX3 | |
| SCHEMBL29967905 | 0.90 | P2RX3 (0.38) | PPARGP2RX3TP53FBP1GAA | |
| SCHEMBL29967514 | 0.90 | CNR2 (0.37) | PPARGP2RX3TP53HRH3GAA | |
| SCHEMBL29968167 | 0.89 | NR1H4 (0.44) | PPARGP2RX3HRH3 | |
| SCHEMBL29967824 | 0.87 | KDM4E (0.49) | CNR2 | |
| SCHEMBL29967830 | 0.86 | PLA2G10 (0.42) | PPARGP2RX3TP53 | |
| SCHEMBL29967497 | 0.84 | PPARG (0.42) | PPARGALDH1A1CNR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260165-B | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2024-08-06 | — | — | CN | disclosed |
| CN-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |