Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | VCP | P55072 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | RARG | P13631 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL19130510 | 1.00 | MAPT (0.46) | MAPTVCPMEN1KMT2AALDH1A1 | |
| SCHEMBL28408574 | 0.93 | MAPT (0.42) | MAPTVCPMEN1KMT2AALDH1A1 | |
| SCHEMBL523695 | 0.89 | MAPT (0.51) | MAPTKMT2AALDH1A1NR1H2APP | |
| SCHEMBL28407155 | 0.84 | KMT2A (0.47) | MAPTMEN1KMT2AALDH1A1TSHR | |
| SCHEMBL23064948 | 0.82 | VCP (0.45) | MAPTVCPMEN1KMT2AALDH1A1 | |
| SCHEMBL19148941 | 0.81 | L3MBTL1 (0.47) | MAPTMEN1KMT2AALDH1A1POLB | |
| SCHEMBL19124263 | 0.81 | L3MBTL1 (0.47) | MAPTMEN1KMT2AALDH1A1POLB | |
| SCHEMBL28604749 | 0.77 | TSHR (0.43) | MAPTMEN1ALDH1A1TSHRCA12 | |
| SCHEMBL4800627 | 0.77 | MAPT (0.40) | MAPTMEN1KMT2AALDH1A1TSHR | |
| SCHEMBL23064944 | 0.76 | ALDH1A1 (0.44) | MAPTVCPMEN1KMT2AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108689893-B | Propargyl sulfone compound and preparation method and application thereof | 南京工业大学 | 2020-05-08 | — | — | CN | claimed |
| CN-108689893-B | Propargyl sulfone compound and preparation method and application thereof | 南京工业大学 | 2020-05-08 | — | — | CN | disclosed |