Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.36 |
| ▸ | MALT1 | Q9UDY8 | 5/20 | 0.35 |
| ▸ | LCAT | P04180 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27640770 | 0.81 | HSD11B1 (0.31) | HSD11B1MALT1LCATTRPA1 | |
| SCHEMBL21645299 | 0.81 | HSD11B1 (0.44) | HSD11B1MALT1TRPV1 | |
| SCHEMBL23005388 | 0.77 | MALT1 (0.42) | HSD11B1MALT1TRPA1TRPV1 | |
| SCHEMBL12528898 | 0.76 | MALT1 (0.40) | HSD11B1MALT1TRPA1TRPV1 | |
| SCHEMBL10300142 | 0.74 | MALT1 (0.37) | HSD11B1MALT1LCATTRPA1TRPV1 | |
| SCHEMBL3740818 | 0.74 | MALT1 (0.40) | MALT1TRPA1TRPV1 | |
| SCHEMBL29276397 | 0.73 | HSD11B1 (0.38) | HSD11B1MALT1TRPA1TRPV1 | |
| SCHEMBL29661865 | 0.73 | CYP2C19 (0.44) | HSD11B1MALT1 | |
| SCHEMBL951112 | 0.73 | CYP2C19 (0.44) | HSD11B1MALT1 | |
| SCHEMBL29661868 | 0.73 | CYP2C19 (0.44) | HSD11B1MALT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107163024-A | A kind of synthetic method of the Ethyl formate of 2 (pyridine radicals of 3 chlorine 2) 5 pyrazolidone 3 | 安徽星宇化工有限公司 | 2017-09-15 | — | — | CN | claimed |
| CN-107163024-A | A kind of synthetic method of the Ethyl formate of 2 (pyridine radicals of 3 chlorine 2) 5 pyrazolidone 3 | 安徽星宇化工有限公司 | 2017-09-15 | — | — | CN | disclosed |
| CN-106928183-A | The preparation method of pyridyl pyrazoles alkanone carboxylic acid compound | 沈阳中化农药化工研发有限公司 | 2017-07-07 | — | — | CN | disclosed |