Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6114729 | 0.78 | KMT2A (0.61) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL9309031 | 0.78 | KMT2A (0.61) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL11162501 | 0.77 | KMT2A (0.55) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL2439083 | 0.76 | CA2 (0.61) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL71841 | 0.76 | KMT2A (0.53) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL29671360 | 0.76 | KMT2A (0.53) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL7619550 | 0.75 | KMT2A (0.57) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL3978412 | 0.75 | CA2 (0.59) | KMT2APRSS1PRSS2PRSS3FAAH | |
| SCHEMBL354454 | 0.75 | KMT2A (0.57) | KMT2APRSS1PRSS2PRSS3FAAH | |
| Benzene SCHEMBL28852658 | 0.75 | KMT2A (0.57) | KMT2APRSS1PRSS2PRSS3FAAH |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106349071-B | The method that no catalyst and condensing agent prepare fatty acid trifluoro ethyl ester | 武汉理工大学 | 2019-01-22 | — | — | CN | disclosed |
| CN-105517995-B | Six-membered C-N bonded aryl sulfide and aryl sulfoxide derivatives as pesticides | 拜耳作物科学股份公司 | 2018-10-02 | — | — | CN | disclosed |
| CN-108473481-A | compounds useful as kinase inhibitors | 洛克索肿瘤学股份有限公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-106349071-A | Method for preparing fatty acid trifluoro-ethyl ester without catalysts or condensation agents | 武汉理工大学 | 2017-01-25 | — | — | CN | disclosed |
| WO-2011101864-A1 | NOVEL PROCESS FOR THE SYNTHESIS OF PHENOXYETHYL DERIVATIVES | PANACEA BIOTEC LTD (IN) | 2011-08-25 | — | — | WO | disclosed |