Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 4/20 | 0.40 |
| ▸ | IL1B | P01584 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.37 |
| ▸ | EHMT2 | Q96KQ7 | 4/20 | 0.36 |
| ▸ | BPTF | Q12830 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.34 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 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 | |
|---|---|---|---|---|
| SCHEMBL30108649 | 0.99 | PRKCI (0.40) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| SCHEMBL30108831 | 0.99 | PRKCI (0.40) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| Hydrochloric Acid SCHEMBL27224428 | 0.83 | PRKCI (0.36) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| Hydrochloric Acid SCHEMBL31057307 | 0.82 | PRKCI (0.39) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| SCHEMBL31057259 | 0.78 | IL1B (0.44) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| SCHEMBL31091197 | 0.77 | PRKCI (0.41) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| Hydrochloric Acid SCHEMBL31057491 | 0.77 | IL1B (0.43) | PRKCIIL1BCHEK1BRD4CHEK2 | |
| SCHEMBL30108641 | 0.74 | KDM4E (0.56) | PRKCICHEK1CHEK2RPS6KB1AURKA | |
| SCHEMBL25858927 | 0.74 | KDM4E (0.56) | PRKCICHEK1CHEK2RPS6KB1AURKA | |
| SCHEMBL25858603 | 0.74 | KDM4E (0.56) | PRKCICHEK1CHEK2RPS6KB1AURKA |
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-2022253326-A1 | NLRP3 INFLAMMASOME INHIBITOR AND APPLICATION THEREOF | 药捷安康(南京)科技股份有限公司 | 2022-12-08 | — | — | WO | disclosed |