Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 4/20 | 0.39 |
| ▸ | KDR | P35968 | 4/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.35 |
| ▸ | GLO1 | Q04760 | 2/20 | 0.34 |
| ▸ | CDC7 | O00311 | 3/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 3/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 3/20 | 0.34 |
| ▸ | PAK4 | O96013 | 3/20 | 0.34 |
| ▸ | PIM1 | P11309 | 3/20 | 0.34 |
| ▸ | PRKACA | P17612 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 3/20 | 0.34 |
| ▸ | FLT3 | P36888 | 3/20 | 0.34 |
| ▸ | CDK8 | P49336 | 3/20 | 0.34 |
| ▸ | CLK2 | P49760 | 3/20 | 0.34 |
| ▸ | GSK3B | P49841 | 3/20 | 0.34 |
| ▸ | CDK9 | P50750 | 3/20 | 0.34 |
| ▸ | PRKX | P51817 | 3/20 | 0.34 |
| ▸ | JAK3 | P52333 | 3/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.34 |
| ▸ | MAP4K2 | Q12851 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26435894 | 0.92 | IL1B (0.39) | IL1BKDRCHEK2GLO1CDC7 | |
| SCHEMBL26435359 | 0.87 | NLRP3 (0.44) | IL1BKDRCHEK2KDM4ELMNA | |
| SCHEMBL26437126 | 0.86 | NLRP3 (0.39) | IL1BKDRCHEK2CDC7DAPK3 | |
| SCHEMBL26435304 | 0.85 | IL1B (0.42) | IL1BKDRCHEK2KDM4ELMNA | |
| SCHEMBL26435876 | 0.85 | IL1B (0.58) | IL1BCHEK2GLO1KDM4ENLRP3 | |
| SCHEMBL26435695 | 0.85 | NLRP3 (0.46) | IL1BCHEK2KDM4ENLRP3BRD4 | |
| SCHEMBL26435664 | 0.85 | IL1B (0.34) | IL1BKDRKDM4ELMNAHSP90AA1 | |
| SCHEMBL26093543 | 0.82 | KCNH2 (0.48) | IL1BKDM4EMAPTNLRP3KAT2B | |
| SCHEMBL30375557 | 0.82 | KCNH2 (0.48) | IL1BKDM4EMAPTNLRP3KAT2B | |
| SCHEMBL26435870 | 0.82 | KCNH2 (0.48) | IL1BKDM4EMAPTNLRP3KAT2B |
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 |