Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 20/20 | 0.37 |
| ▸ | TNF | P01375 | 5/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16906662 | 0.72 | SDHB (0.52) | — | |
| SCHEMBL3295796 | 0.71 | TRPV4 (0.48) | — | |
| SCHEMBL14451034 | 0.70 | RAB9A (0.47) | — | |
| SCHEMBL22695168 | 0.70 | IL1B (0.47) | IL1BTNFNLRP3 | |
| SCHEMBL22695112 | 0.68 | IL1B (0.55) | IL1BTNFNLRP3 | |
| SCHEMBL30612218 | 0.68 | HSP90AA1 (0.39) | — | |
| SCHEMBL335132 | 0.68 | HSP90AA1 (0.39) | — | |
| SCHEMBL9924167 | 0.65 | TRPV4 (0.39) | — | |
| SCHEMBL154945 | 0.65 | GABRA1 (0.49) | — | |
| Hydrochloric Acid SCHEMBL28478663 | 0.65 | HSP90AA1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109678908-A | It is a kind of using pyridyl derivatives as bicyclic metal platinum (II) complex of ligand and its preparation method and application | 安徽工业大学 | 2019-04-26 | — | — | CN | disclosed |