Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 5/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29661868 | 0.78 | CYP2C19 (0.44) | HSD11B1MALT1 | |
| SCHEMBL951112 | 0.78 | CYP2C19 (0.44) | HSD11B1MALT1 | |
| SCHEMBL29661865 | 0.78 | CYP2C19 (0.44) | HSD11B1MALT1 | |
| SCHEMBL12528898 | 0.76 | MALT1 (0.40) | HSD11B1MALT1TRPA1TRPV1 | |
| SCHEMBL3740818 | 0.76 | MALT1 (0.40) | MALT1TRPA1TRPV1 | |
| SCHEMBL21645299 | 0.76 | HSD11B1 (0.44) | HSD11B1MALT1TRPV1 | |
| SCHEMBL23005388 | 0.75 | MALT1 (0.42) | HSD11B1MALT1TRPA1TRPV1 | |
| SCHEMBL29661853 | 0.74 | NPFFR1 (0.37) | HSD11B1MALT1TRPA1TRPV1 | |
| Acetonitrile SCHEMBL28442107 | 0.74 | CYP2C19 (0.41) | HSD11B1MALT1 | |
| SCHEMBL28160565 | 0.73 | HSD11B1 (0.36) | HSD11B1MALT1TRPA1TRPV1 |
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-117143075-A | Synthesis process of 2- (3-chloro-2-pyridyl) -5-oxo-3-pyrazolidine ethyl carboxylate | 宁夏佰斯特医药化工有限公司 | 2023-12-01 | — | — | CN | claimed |
| CN-117143075-A | Synthesis process of 2- (3-chloro-2-pyridyl) -5-oxo-3-pyrazolidine ethyl carboxylate | 宁夏佰斯特医药化工有限公司 | 2023-12-01 | — | — | CN | disclosed |