Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | SHBG | P04278 | 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 | |
|---|---|---|---|---|
| SCHEMBL6327300 | 0.91 | ACE (0.38) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3542534 | 0.86 | ACE (0.32) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6909518 | 0.83 | ACE (0.43) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10453942 | 0.78 | CYP2D6 (0.44) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13104108 | 0.78 | CYP2D6 (0.44) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28379100 | 0.77 | CYP2D6 (0.50) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL29107614 | 0.77 | CYP2D6 (0.50) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL87947 | 0.77 | CYP2D6 (0.50) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL6327467 | 0.77 | ALDH1A1 (0.34) | ACEALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10710430 | 0.75 | CA1 (0.37) | ACEPIK3CDCA1MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1372210-B1 | NON-AQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY | UBE INDUSTRIES (JP) | 2010-04-21 | — | — | EP | disclosed |
| US-7550233-B2 | Nonaqueous electrolytic solution containing ketone compound and lithium secondary battery | UBE INDUSTRIES, LTD. (JP) | 2009-06-23 | — | — | US | disclosed |
| US-20040096748-A1 | Nonaqueous electrolytic solution and lithium secondary battery | UBE INDUSTRIES, LTD. (JP) | 2004-05-20 | — | — | US | disclosed |
| EP-1372210-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY | Ube Industries, Ltd. (JP) | 2003-12-17 | — | — | EP | disclosed |