Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.32 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.30 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5964251 | 0.89 | DHFR (0.31) | DHFR | |
| SCHEMBL5963759 | 0.82 | RAD52 (0.40) | ALDH1A1RAD52EPHX1LPAR1LPAR3 | |
| SCHEMBL11233641 | 0.81 | — | — | |
| SCHEMBL5963386 | 0.80 | RAD52 (0.39) | ALDH1A1RAD52EPHX1LPAR1LPAR3 | |
| SCHEMBL5963827 | 0.78 | RAD52 (0.38) | ALDH1A1RAD52EPHX1CYP1A2 | |
| SCHEMBL5963590 | 0.77 | CYP1A2 (0.38) | ALDH1A1RAD52EPHX1CYP1A2 | |
| SCHEMBL5963835 | 0.77 | CYP1A2 (0.38) | ALDH1A1RAD52EPHX1CYP1A2 | |
| SCHEMBL11123711 | 0.76 | ALDH1A1 (0.57) | ALDH1A1LPAR1LPAR3ENPP2 | |
| SCHEMBL8471753 | 0.74 | — | — | |
| SCHEMBL17232174 | 0.73 | LPAR1 (0.62) | LPAR1LPAR3ENPP2 |
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-20060172201-A1 | Non-aqueous electrolyte and lithium secondary battery using the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2006-08-03 | — | — | US | disclosed |
| EP-1357628-A1 | NONAQUEOUS ELECTROLYTIC LIQUIDS AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2003-10-29 | — | — | EP | disclosed |