Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 5/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | TRPC4 | Q9UBN4 | 2/20 | 0.39 |
| ▸ | TRPC5 | Q9UL62 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | TRPC1 | P48995 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | GPR18 | Q14330 | 1/20 | 0.37 |
| ▸ | MTHFD2 | P13995 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | STAT6 | P42226 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31042873 | 0.91 | TRPC5 (0.47) | P2RX3MAOBTRPC4TRPC5KCNH2 | |
| SCHEMBL31042881 | 0.90 | PCSK9 (0.43) | P2RX3TRPC4TRPC5KCNH2TRPC1 | |
| SCHEMBL31042911 | 0.90 | TP53 (0.46) | P2RX3TRPC4TRPC5KCNH2TRPC1 | |
| SCHEMBL31042882 | 0.85 | TRPC5 (0.49) | TRPC4TRPC5KCNH2TRPC1TP53 | |
| SCHEMBL31042922 | 0.81 | TRPC5 (0.56) | TRPC4TRPC5KCNH2TRPC1TP53 | |
| SCHEMBL31042863 | 0.81 | PCSK9 (0.49) | TRPC4TRPC5KCNH2TRPC1TP53 | |
| SCHEMBL31042895 | 0.80 | TRPC5 (0.44) | P2RX3TRPC4TRPC5KCNH2TRPC1 | |
| SCHEMBL31042869 | 0.79 | TRPC5 (0.34) | P2RX3TRPC4TRPC5KCNH2TRPC1 | |
| SCHEMBL31042875 | 0.78 | BRAF (0.54) | TRPC4TRPC5KCNH2TRPC1MAPT | |
| SCHEMBL31042903 | 0.77 | TRPC4 (0.43) | TRPC4TRPC5KCNH2TRPC1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4663640-A1 | XANTHINE COMPOUND AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2025-12-17 | — | — | EP | disclosed |
| WO-2024164818-A1 | XANTHINE COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2024-08-15 | — | — | WO | disclosed |