Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL5014758 | 0.90 | CASP1 (0.32) | — | |
| Trifluoroacetic Acid SCHEMBL6420425 | 0.84 | CA4 (0.33) | — | |
| SCHEMBL4962837 | 0.83 | CASP1 (0.32) | — | |
| Potassium Ion SCHEMBL28438583 | 0.83 | CA4 (0.40) | — | |
| SCHEMBL30057322 | 0.83 | CA4 (0.40) | — | |
| Silver SCHEMBL4962831 | 0.83 | CASP1 (0.32) | — | |
| Lithium Ion SCHEMBL1011563 | 0.81 | — | — | |
| Lithium Ion SCHEMBL17837120 | 0.81 | CA4 (0.32) | — | |
| Lithium Ion SCHEMBL10456250 | 0.78 | THRB (0.33) | — | |
| Lithium Ion SCHEMBL5963065 | 0.78 | THRB (0.33) | — |
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-8445137-B1 | Primary battery having sloped voltage decay | QUALLION LLC (US) | 2013-05-21 | — | — | US | disclosed |
| WO-2004023577-A2 | ELECTROLYTE | QUALLION LLC (US) | 2004-03-18 | — | — | WO | disclosed |