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.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 18/20 | 0.37 |
| ▸ | CA1 | P00915 | 17/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | MMP8 | P22894 | 2/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL28821955 | 0.83 | CA2 (0.43) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL7732766 | 0.79 | F2 (0.38) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL2021790 | 0.78 | CA2 (0.50) | CA2CA1MMP1MMP2MMP9 | |
| Lithium Ion SCHEMBL1865839 | 0.78 | — | — | |
| SCHEMBL14973555 | 0.76 | CA2 (0.48) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL4937413 | 0.76 | CA2 (0.54) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL11889526 | 0.76 | CA2 (0.48) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL9016133 | 0.76 | CA2 (0.48) | CA2CA1MMP1MMP2MMP9 | |
| Ammonia Solution, Strong SCHEMBL14973502 | 0.76 | CA2 (0.48) | CA2CA1MMP1MMP2MMP9 | |
| Potassium SCHEMBL30990109 | 0.76 | CA2 (0.48) | CA2CA1MMP1MMP2MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020039677-A1 | Where the difference ( gamma l-gamma se) between the surface tension gamma yl of electrolyte and the surface free energy gamma se of electrode is not more than 10 dynes/cm. | MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) | 2002-04-04 | — | — | US | disclosed |