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 SCHEMBL28411406 | 0.82 | — | — | |
| Lithium Ion SCHEMBL1714 | 0.82 | — | — | |
| Lithium Ion SCHEMBL26656220 | 0.82 | — | — | |
| Lithium Ion SCHEMBL1890966 | 0.82 | — | — | |
| Lithium Ion SCHEMBL8675018 | 0.82 | CYP3A4 (0.33) | — | |
| Water SCHEMBL2385745 | 0.82 | — | — | |
| Lithium Ion SCHEMBL28269112 | 0.82 | CYP3A4 (0.33) | — | |
| Potassium Ion SCHEMBL2747517 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL5702304 | 0.67 | — | — | |
| Water SCHEMBL502820 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106795150-B | 1,3,4- thiadiazole compound and its purposes in treating cancer | 阿斯利康(瑞典)有限公司 | 2019-10-15 | — | — | CN | disclosed |
| CN-106795150-A | 1,3,4 thiadiazole compounds and its purposes in treating cancer | 阿斯利康(瑞典)有限公司 | 2017-05-31 | — | — | CN | disclosed |
| US-5331006-A | Cholecystokinin, antisecretory agents | WARNER-LAMBERT COMPANY (US) | 1994-07-19 | — | — | US | disclosed |
| WO-1992004025-A1 | AMINO ACID ANALOGS AS CCK ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1992-03-19 | — | — | WO | disclosed |