Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KCNJ6 | P48051 | 3/20 | 0.31 |
| ▸ | KCNJ3 | P48549 | 3/20 | 0.31 |
| ▸ | KCNJ5 | P48544 | 2/20 | 0.31 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28395388 | 0.90 | RECQL (0.34) | RECQLMAPTGAAPTGS2CCNA2 | |
| SCHEMBL28396598 | 0.87 | PTGS2 (0.46) | MAPTGAAPTGS2CCNA2CDK2 | |
| SCHEMBL28398223 | 0.87 | MAPK14 (0.38) | MAPTPTGS2ALDH1A1NPC1LMNA | |
| SCHEMBL28392425 | 0.87 | MAPT (0.37) | MAPTGAAPTGS2ALDH1A1NPC1 | |
| SCHEMBL28398492 | 0.87 | BCAT1 (0.38) | MAPTGAAALDH1A1LMNAKCNJ6 | |
| SCHEMBL28405837 | 0.86 | RPA1 (0.35) | MAPTNPC1LMNAHTTRAB9A | |
| SCHEMBL28392586 | 0.86 | ALDH1A1 (0.45) | RECQLMAPTGAACCNA2CDK2 | |
| SCHEMBL28397376 | 0.84 | GRM5 (0.35) | MAPTPTGS2KDM1AALDH1A1NPC1 | |
| SCHEMBL28400108 | 0.79 | KMT2A (0.39) | PTGS2HTTKCNJ6KCNJ3KCNJ5 | |
| SCHEMBL28396599 | 0.78 | PTGS2 (0.44) | MAPTGAAPTGS2CCNA2CDK2 |
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 |