Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| 1,4-Dimethoxybenzene SCHEMBL29157786 | 0.89 | CA1 (0.58) | MAPTRAB9AMAPK1NPSR1CA12 | |
| SCHEMBL9301 | 0.82 | — | — | |
| SCHEMBL10605468 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| SCHEMBL30056198 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| SCHEMBL109479 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| Bromomethane SCHEMBL9702151 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| Phosphine SCHEMBL9754815 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| SCHEMBL5466009 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| Magnesium SCHEMBL31191739 | 0.79 | CA1 (0.65) | KMT2AMAPTMEN1RAB9ALMNA | |
| Tetrahydrofuran SCHEMBL21001799 | 0.79 | TDP1 (0.67) | MAPTRAB9AMAPK1CA12CA1 |
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-104844654-B | A kind of quaternary salt compounds and preparation method thereof | 昆明理工大学 | 2016-11-02 | — | — | CN | disclosed |
| CN-104844654-A | Quaternary phosphonium salt compound and preparation method thereof | UNIV KUNMING SCIENCE & TECHNOLOGY | 2015-08-19 | — | — | CN | disclosed |