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 | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | PKLR | P30613 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 3/20 | 0.40 |
| ▸ | EDNRA | P25101 | 3/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | PGAM1 | P18669 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 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 | |
|---|---|---|---|---|
| SCHEMBL1870051 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL31276980 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL4887779 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL4889382 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL29194064 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| Potassium Ion SCHEMBL3400358 | 0.96 | PTGS2 (0.48) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL29213550 | 0.91 | PKLR (0.46) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL310987 | 0.89 | PTGS2 (0.52) | PTGS2AKR1B1PKLRALDH1A1TDP1 | |
| Potassium Ion SCHEMBL14740336 | 0.89 | PTGS2 (0.52) | PTGS2AKR1B1CASP1PKLRALDH1A1 | |
| SCHEMBL31323345 | 0.89 | PTGS2 (0.52) | PTGS2AKR1B1PKLRALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2010015885-A | ANODE, CATHODE, SECONDARY BATTERY, AND THEIR MANUFACTURING METHODS | SONY CORP | 2010-01-21 | — | — | JP | disclosed |