Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.33 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28398225 | 0.90 | SMN1; SMN2 (0.39) | MAPK14SMN1; SMN2NPSR1MAPTCDK8 | |
| SCHEMBL28392586 | 0.89 | ALDH1A1 (0.45) | MAPK14SMN1; SMN2MAPTKCNK3MAPK13 | |
| SCHEMBL28396598 | 0.87 | PTGS2 (0.46) | MAPK14SMN1; SMN2MAPTLMNAALDH1A1 | |
| SCHEMBL28392425 | 0.87 | MAPT (0.37) | MAPK14SMN1; SMN2MAPTMAPK13MAPK12 | |
| SCHEMBL28395385 | 0.87 | RECQL (0.35) | SMN1; SMN2MAPTLMNAALDH1A1NPC1 | |
| SCHEMBL28398492 | 0.87 | BCAT1 (0.38) | MAPK14MAPTMAPK13MAPK12MAPK11 | |
| SCHEMBL28397376 | 0.84 | GRM5 (0.35) | SMN1; SMN2MAPTALDH1A1CYP2C9NPC1 | |
| SCHEMBL28405837 | 0.79 | RPA1 (0.35) | SMN1; SMN2MAPTLMNANPC1HTT | |
| SCHEMBL28400108 | 0.79 | KMT2A (0.39) | MAPK14HTTKCNJ6KCNJ5KCNJ3 | |
| SCHEMBL28392588 | 0.79 | ALDH1A1 (0.44) | MAPK14SMN1; SMN2MAPTKCNK3MAPK13 |
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-108203450-B | Preparation method and application of amino phosphonate containing arylpyrazole compound | 南京工业大学 | 2020-05-19 | — | — | CN | disclosed |