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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA9 | Q16790 | 4/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DUSP5 | Q16690 | 2/20 | 0.33 |
| ▸ | DUSP6 | Q16828 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | PRKCA | P17252 | 2/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.32 |
| ▸ | F11 | P03951 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4605272 | 0.85 | CA12 (0.53) | CA12CA1CA2CA9CA14 | |
| SCHEMBL4606941 | 0.85 | CA12 (0.53) | CA12CA1CA2CA9CA14 | |
| SCHEMBL4606650 | 0.85 | CA12 (0.53) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6856358 | 0.82 | CA12 (0.39) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6296712 | 0.82 | CA12 (0.39) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6291891 | 0.80 | CA2 (0.37) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6854226 | 0.80 | CA2 (0.37) | CA12CA1CA2CA9CA14 | |
| SCHEMBL9556912 | 0.79 | CA12 (0.46) | CA12CA1CA2CA9CA14 | |
| Lithium Ion SCHEMBL472702 | 0.79 | CA12 (0.48) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6292960 | 0.78 | PRKCA (0.49) | CA12CA1CA2CA9CA14 |
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-0073437-A2 | Dyed polyester fiber composite structure | TEIJIN LIMITED (JP) | 1983-03-09 | — | — | EP | disclosed |