Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 4/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 5/20 | 0.38 |
| ▸ | IL1B | P01584 | 3/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.35 |
| ▸ | CCNK | O75909 | 2/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK9 | P50750 | 2/20 | 0.35 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.35 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | CCNH | P51946 | 1/20 | 0.34 |
| ▸ | MNAT1 | P51948 | 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 | |
|---|---|---|---|---|
| SCHEMBL29030535 | 1.00 | CHEK2 (0.40) | CHEK2NLRP3IL1BCHEK1PDPK1 | |
| SCHEMBL30488558 | 1.00 | CHEK2 (0.40) | CHEK2NLRP3IL1BCHEK1PDPK1 | |
| SCHEMBL29030533 | 1.00 | CHEK2 (0.40) | CHEK2NLRP3IL1BCHEK1PDPK1 | |
| SCHEMBL25301015 | 0.96 | CHEK2 (0.41) | CHEK2NLRP3IL1BCHEK1PDPK1 | |
| SCHEMBL25301014 | 0.96 | CHEK2 (0.41) | CHEK2NLRP3IL1BCHEK1PDPK1 | |
| SCHEMBL30488547 | 0.81 | NLRP3 (0.58) | NLRP3IL1B | |
| SCHEMBL29030490 | 0.81 | NLRP3 (0.58) | NLRP3IL1B | |
| SCHEMBL29030484 | 0.81 | NLRP3 (0.58) | NLRP3IL1B | |
| SCHEMBL30488523 | 0.81 | NLRP3 (0.58) | NLRP3IL1B | |
| SCHEMBL25302382 | 0.80 | CHEK1 (0.43) | CHEK2NLRP3IL1BCHEK1PDPK1 |
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-119798221-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2025-04-11 | — | — | CN | disclosed |
| CN-116410140-A | NLRP3 inflammation corpuscle inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2023-07-11 | — | — | CN | disclosed |