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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 11/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL493770 | 0.95 | SLC6A2 (0.35) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 | |
| SCHEMBL4259328 | 0.95 | SLC6A2 (0.35) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 | |
| SCHEMBL22097765 | 0.80 | TDP1 (0.34) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 | |
| SCHEMBL4260062 | 0.79 | SLC6A2 (0.33) | SLC6A2SLC6A4CHRM1ALDH1A1HIF1A | |
| SCHEMBL21551717 | 0.79 | GABBR2 (0.39) | SLC6A2SLC6A4CHRM1SMN1; SMN2GABBR2 | |
| SCHEMBL4414784 | 0.79 | SLC6A2 (0.37) | SLC6A2SLC6A4ALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL4416823 | 0.79 | SLC6A2 (0.37) | SLC6A2SLC6A4ALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL22728188 | 0.79 | ATM (0.44) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 | |
| SCHEMBL10019607 | 0.79 | SLC6A2 (0.38) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 | |
| SCHEMBL8031389 | 0.78 | TAAR1 (0.48) | SLC6A2SLC6A4CYP3A4CYP2D6SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1636221-A2 | NEW AZETIDINE COMPOUNDS | AstraZeneca AB (SE) | 2006-03-22 | — | — | EP | disclosed |
| WO-2004110344-A2 | NEW AZETIDINE COMPOUNDS | ASTRAZENECA AB (SE) | 2004-12-23 | — | — | WO | disclosed |