Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL10127480 | 0.81 | KDM4E (0.33) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL232706 | 0.75 | — | — | |
| SCHEMBL2035630 | 0.72 | CES2 (0.41) | HSD17B10ALDH1A1SRD5A2 | |
| SCHEMBL13630664 | 0.72 | KDM4C (0.41) | ALDH1A1 | |
| SCHEMBL95764 | 0.72 | ALDH1A1 (0.35) | ALDH1A1KDM4EHPGDSRD5A2 | |
| SCHEMBL95763 | 0.72 | ALDH1A1 (0.35) | ALDH1A1KDM4EHPGDSRD5A2 | |
| SCHEMBL6178447 | 0.71 | LMNA (0.56) | CYP1A2CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL9911540 | 0.70 | — | — | |
| SCHEMBL5209290 | 0.70 | ALDH1A1 (0.34) | ALDH1A1SRD5A2 | |
| SCHEMBL2835998 | 0.70 | GABRP (0.36) | CYP1A2ALDH1A1KDM4EHPGDSRD5A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3518334-A1 | NON-AQUEOUS ELECTROLYTE SOLUTION ADDITIVE, NON-AQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY, COMPRISING NON-AQUEOUS ELECTROLYTE SOLUTION ADDITIVE | LG Chem, Ltd. (KR) | 2019-07-31 | — | — | EP | disclosed |