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 | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6386932 | 0.94 | IDO1 (0.50) | IDO1LOXL2TAAR1AGXTPLA2G1B | |
| SCHEMBL1468357 | 0.71 | IDO1 (0.58) | IDO1LOXL2TAAR1AGXTPLA2G1B | |
| SCHEMBL7437052 | 0.71 | TAAR1 (0.68) | IDO1LOXL2TAAR1AGXTMAOB | |
| SCHEMBL16561361 | 0.71 | IDO1 (0.58) | IDO1LOXL2TAAR1AGXTPLA2G1B | |
| Lithium Ion SCHEMBL7741317 | 0.71 | IDO1 (0.50) | IDO1TAAR1AGXTLMNACHRM2 | |
| Lithium Ion SCHEMBL7742851 | 0.71 | CYP2A6 (0.47) | IDO1TAAR1MAOB | |
| SCHEMBL5186843 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL7941845 | 0.69 | IDO1 (0.55) | IDO1LOXL2TAAR1AGXTPLA2G1B | |
| SCHEMBL283761 | 0.69 | — | — | |
| SCHEMBL13499 | 0.69 | — | — |
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-6413677-B1 | THIOCARBONATE ELECTROLYTE | UBE INDUSTRIES, LTD. (JP) | 2002-07-02 | — | — | US | disclosed |