Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | PTGIR | P43119 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | FBP1 | P09467 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29967492 | 0.96 | TP53 (0.39) | P2RX3TP53MAPTPPARGCNR2 | |
| SCHEMBL29967912 | 0.91 | P2RX3 (0.39) | P2RX3PPARGCNR2PTGDR2 | |
| SCHEMBL29968376 | 0.90 | PPARG (0.41) | P2RX3TP53PPARGCNR2GAA | |
| SCHEMBL29967886 | 0.90 | PPARG (0.40) | P2RX3TP53PPARGFBP1 | |
| SCHEMBL29967574 | 0.88 | PPARG (0.41) | P2RX3TP53MAPTPPARGCCR2 | |
| SCHEMBL29967830 | 0.86 | PLA2G10 (0.42) | P2RX3TP53MAPTPPARGCCR2 | |
| SCHEMBL29967971 | 0.84 | PPARG (0.42) | P2RX3PPARG | |
| SCHEMBL29967514 | 0.84 | CNR2 (0.37) | P2RX3TP53PPARGCNR2PTGDR2 | |
| SCHEMBL29968184 | 0.83 | PPARG (0.43) | P2RX3PPARG | |
| SCHEMBL29968167 | 0.82 | NR1H4 (0.44) | P2RX3PPARG |
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 |