Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 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 | |
|---|---|---|---|---|
| SCHEMBL30132956 | 0.97 | CYP1A2 (0.35) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL3621491 | 0.86 | ALDH1A1 (0.53) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL3620023 | 0.86 | CYP1A2 (0.30) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL3950568 | 0.85 | — | — | |
| SCHEMBL4203225 | 0.82 | — | — | |
| SCHEMBL28190865 | 0.82 | KDM4E (0.30) | — | |
| SCHEMBL3626588 | 0.80 | ALDH1A1 (0.37) | ALDH1A1TSHR | |
| SCHEMBL11974550 | 0.79 | ALDH1A1 (0.35) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL1415374 | 0.78 | — | — | |
| SCHEMBL3626230 | 0.78 | — | — |
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-7695863-B2 | rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive | UBE INDUSTRIES, LTD. (JP) | 2010-04-13 | — | — | US | disclosed |
| US-20080102377-A1 | rechargeable batteries having excellent battery cycle properties, electrical capacity and storage characteristic during charging, comprising electrodes and a nonaqueous electrolytic solution containing a dicarbonyl compound as an additive | UBE INDUSTRIES, LTD (JP) | 2008-05-01 | — | — | US | disclosed |