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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B known ✓ | P49841 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | BCL2 | P10415 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 2/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | DEGS1 | O15121 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.40 |
| ▸ | NNMT | P40261 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2877186 | 0.85 | HCAR3 (0.57) | GRIN2BHDAC1BCL2HCAR3 | |
| SCHEMBL28658285 | 0.85 | GRIN2B (0.48) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL29651977 | 0.85 | HCAR3 (0.57) | GRIN2BHDAC1BCL2HCAR3 | |
| SCHEMBL31727242 | 0.85 | GRIN2B (0.48) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL7936803 | 0.84 | HCAR3 (0.55) | GRIN2BHDAC1BCL2HCAR3 | |
| SCHEMBL2772417 | 0.84 | MAPK1 (0.51) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL5734042 | 0.84 | NNMT (0.58) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL20828520 | 0.83 | GRIN2B (0.47) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL13876322 | 0.83 | GRIN2B (0.47) | GRIN2BHDAC1BCL2NAMPTGSK3B | |
| SCHEMBL31599569 | 0.83 | GRIN2B (0.47) | GRIN2BHDAC1BCL2NAMPTGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001017992-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |