Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | BHMT | Q93088 | 1/20 | 0.34 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5076969 | 0.90 | BLM (0.52) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL18791193 | 0.90 | BLM (0.52) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL28055103 | 0.88 | ACE2 (0.52) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL9333340 | 0.83 | LTA4H (0.50) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL4653508 | 0.82 | ACE2 (0.50) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL7897955 | 0.82 | ACE2 (0.50) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL7203810 | 0.82 | ACE2 (0.50) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL3693315 | 0.82 | ACE2 (0.50) | ACE2BLMGABRR1CYP1A2LTA4H | |
| SCHEMBL287670 | 0.81 | — | — | |
| SCHEMBL11879730 | 0.81 | BLM (0.83) | ACE2BLMGABRR1CYP1A2LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| CN-105406119-B | A kind of lithium-ion battery electrolytes and the lithium ion battery containing the electrolyte | 比亚迪股份有限公司 | 2018-05-29 | — | — | CN | disclosed |
| CN-105406119-A | Lithium ion battery electrolyte and lithium ion battery containing electrolyte | BYD CO LTD | 2016-03-16 | — | — | CN | disclosed |