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 SCHEMBL28573036 | 0.90 | CASP1 (0.32) | — | |
| Trifluoroacetic Acid SCHEMBL6420425 | 0.84 | CA4 (0.33) | — | |
| SCHEMBL28445980 | 0.83 | CA4 (0.40) | — | |
| Lithium Ion SCHEMBL17837120 | 0.81 | CA4 (0.32) | — | |
| Lithium Ion SCHEMBL6766064 | 0.81 | — | — | |
| Oxalic Acid SCHEMBL5016867 | 0.80 | — | — | |
| Lithium Ion SCHEMBL28224974 | 0.75 | ALDH1A1 (0.33) | — | |
| Lithium Ion SCHEMBL7106890 | 0.75 | — | — | |
| Trifluoroacetic Acid SCHEMBL104453 | 0.72 | — | — | |
| Bicarbonate SCHEMBL17839024 | 0.71 | CA4 (0.39) | — |
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-1875540-B1 | NON-AQUEOUS ELECTROLYTIC SOLUTION | NOVOLYTE TECHNOLOGIES INC (US) | 2011-01-05 | — | — | EP | claimed |