Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 2/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 8/20 | 0.37 |
| ▸ | IL1B | P01584 | 8/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | CCR4 | P51679 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29042803 | 0.93 | NLRP3 (0.37) | PIK3CDNLRP3IL1BGABRA5KCNH2 | |
| SCHEMBL29042799 | 0.92 | NLRP3 (0.37) | PIK3CDNLRP3IL1BKCNH2TNF | |
| SCHEMBL29042800 | 0.92 | NLRP3 (0.37) | PIK3CDNLRP3IL1BKCNH2TNF | |
| SCHEMBL26440756 | 0.89 | NLRP3 (0.35) | NLRP3IL1BGABRA5KCNH2TNF | |
| SCHEMBL31072358 | 0.89 | NLRP3 (0.36) | NLRP3IL1BKCNH2TNFJAK1 | |
| SCHEMBL30374802 | 0.88 | NLRP3 (0.34) | PIK3CDNLRP3IL1BGABRA5KCNH2 | |
| SCHEMBL29043041 | 0.88 | IL1B (0.45) | PIK3CDNLRP3IL1BKCNH2ROCK2 | |
| SCHEMBL29043042 | 0.88 | IL1B (0.45) | PIK3CDNLRP3IL1BKCNH2ROCK2 | |
| SCHEMBL31072365 | 0.88 | IL1B (0.47) | PIK3CDNLRP3IL1BGABRA5KCNH2 | |
| SCHEMBL26439655 | 0.88 | IL1B (0.47) | PIK3CDNLRP3IL1BGABRA5KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023066377-A1 | NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 索智生物科技（浙江）有限公司 | 2023-04-27 | — | — | WO | disclosed |