Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 9/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL779346 | 0.82 | GRM2 (0.39) | ALDH1A1MAPTL3MBTL1ACMSDDHODH | |
| SCHEMBL3893674 | 0.78 | PTPRC (0.41) | ALDH1A1MAPTL3MBTL1PTPRCPTPN1 | |
| SCHEMBL777427 | 0.77 | MAPT (0.34) | ALDH1A1MAPTL3MBTL1NPSR1GRM2 | |
| SCHEMBL779347 | 0.70 | MYC (0.38) | ALDH1A1MAPTL3MBTL1ACMSDDHODH | |
| SCHEMBL10024266 | 0.66 | ACMSD (0.65) | ALDH1A1MAPTL3MBTL1PTPRCPTPN1 | |
| SCHEMBL3883387 | 0.65 | GRM2 (0.39) | ALDH1A1MAPTL3MBTL1PTPRCPTPN1 | |
| SCHEMBL27900617 | 0.65 | ACMSD (0.64) | ALDH1A1ACMSDDHODHDHFRALKBH5 | |
| SCHEMBL29883839 | 0.65 | ALDH1A1 (0.37) | ALDH1A1MAPTNPSR1NPC1RAB9A | |
| SCHEMBL28232231 | 0.65 | ALDH1A1 (0.37) | ALDH1A1MAPTNPSR1NPC1RAB9A | |
| SCHEMBL28116695 | 0.65 | PTPRC (0.54) | ALDH1A1MAPTL3MBTL1PTPRCPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9252457-B2 | Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery | MITSUBISHI CHEMICAL CORPORATION (JP) | 2016-02-02 | — | — | US | disclosed |
| US-20120070731-A1 | NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2012-03-22 | — | — | US | disclosed |