Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 7/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.38 |
| ▸ | CASP3 | P42574 | 3/20 | 0.38 |
| ▸ | CASP7 | P55210 | 3/20 | 0.38 |
| ▸ | EHMT1 | Q9H9B1 | 2/20 | 0.36 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL26115214 | 1.00 | CDK9 (0.38) | CDK9CCNT1CASP3CASP7EHMT1 | |
| SCHEMBL26113292 | 0.96 | CCNT1 (0.38) | CDK9CCNT1CASP3CASP7EHMT1 | |
| SCHEMBL31359756 | 0.96 | CCNT1 (0.38) | CDK9CCNT1CASP3CASP7EHMT1 | |
| SCHEMBL26114657 | 0.87 | CDK9 (0.37) | CDK9CCNT1CASP3CASP7KCNH2 | |
| SCHEMBL31359746 | 0.84 | GPBAR1 (0.45) | CDK9CCNT1EHMT2 | |
| SCHEMBL26515018 | 0.84 | GPBAR1 (0.45) | CDK9CCNT1EHMT2 | |
| SCHEMBL26118444 | 0.84 | CDK9 (0.37) | CDK9CCNT1CASP3CASP7KCNH2 | |
| SCHEMBL31359812 | 0.82 | NLRP3 (0.34) | EHMT1NLRP3 | |
| SCHEMBL26117112 | 0.82 | NLRP3 (0.34) | EHMT1NLRP3 | |
| SCHEMBL31359741 | 0.82 | NLRP3 (0.35) | NLRP3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4504733-A1 | FUSED PYRIDAZINE DERIVATIVES AS NLRP3 INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2025-02-12 | — | — | EP | disclosed |