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 | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 6/20 | 0.51 |
| ▸ | SSTR5 | P35346 | 5/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | EED | O75530 | 2/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MLNR | O43193 | 1/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | HLA-A | P04439 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7981024 | 0.94 | HRH1 (0.52) | HRH1SSTR5KCNH2LMNAGAA | |
| Lithium Ion SCHEMBL7985871 | 0.94 | HRH1 (0.52) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL7984750 | 0.94 | HRH1 (0.52) | HRH1SSTR5KCNH2LMNAGAA | |
| Hydrochloric Acid SCHEMBL7971593 | 0.94 | HRH1 (0.52) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL7970924 | 0.92 | HRH1 (0.53) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL7001556 | 0.91 | SSTR5 (0.58) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL7985525 | 0.91 | HRH1 (0.53) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL7985864 | 0.90 | HRH1 (0.53) | HRH1SSTR5KCNH2LMNAGAA | |
| Hydrochloric Acid SCHEMBL7971877 | 0.90 | HRH1 (0.53) | HRH1SSTR5KCNH2LMNAGAA | |
| SCHEMBL6993261 | 0.89 | HRH1 (0.61) | HRH1SSTR5KCNH2LMNAGAA |
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-6211199-B1 | HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS | AVENTIS PHARMACEUTICALS INC. | 2001-04-03 | — | — | US | disclosed |