Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15165757 | 0.86 | PDE4D (0.50) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL14812013 | 0.85 | PDE4D (0.67) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL2084738 | 0.84 | SMN1; SMN2 (0.50) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL20583553 | 0.84 | PDE4D (0.49) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL28350936 | 0.84 | PDE4D (0.65) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL28112151 | 0.83 | PDE4D (0.42) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL4650693 | 0.82 | KDM4E (0.52) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL20075372 | 0.79 | PDE4D (0.39) | PDE4DKDM4ELMNAALDH1A1NPSR1 | |
| SCHEMBL353564 | 0.79 | PDE4D (1.00) | PDE4DKDM4EMAPTPOLBKMT2A | |
| SCHEMBL22637869 | 0.78 | PDE4D (0.38) | PDE4DKDM4EKMT2ALMNAMAPK1 |
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-106467492-B | preparation method of polyfluoromethyl pyrazole compound, intermediate and preparation method | 联化科技(盐城)有限公司 | 2019-12-17 | — | — | CN | disclosed |
| WO-2014033164-A1 | PROCEDURE FOR THE DECARBOXYLATION OF 3,5-BIS(HALOALKYL)-PYRAZOLE-4-CARBOXYLIC ACID DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2014-03-06 | — | — | WO | disclosed |
| WO-2012025469-A1 | IMPROVED PROCESS FOR THE PREPARATION OF ESTERS OF 1-H-PYRAZOLE-4-CARBOXYLIC ACIDS | SOLVAY SA (BE) | 2012-03-01 | — | — | WO | disclosed |