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 | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 3/20 | 0.64 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | ACLY | P53396 | 3/20 | 0.56 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.52 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL6112283 | 0.84 | LMNA (0.67) | METAP2CYP2C9CYP2C19LMNATSHR | |
| SCHEMBL12201452 | 0.82 | ACLY (0.74) | METAP2MCL1CYP2C9CYP2C19ACLY | |
| Zinc Ion SCHEMBL9443911 | 0.81 | LMNA (0.67) | METAP2CYP2C9CYP2C19LMNATSHR | |
| SCHEMBL10487706 | 0.81 | KMT2A (0.60) | METAP2CYP2C9CYP2C19LMNATSHR | |
| SCHEMBL10487704 | 0.79 | KMT2A (0.58) | METAP2CYP2C9CYP2C19LMNATSHR | |
| Zinc Ion SCHEMBL9443907 | 0.79 | KMT2A (0.58) | METAP2CYP2C9CYP2C19LMNATSHR | |
| SCHEMBL7579963 | 0.79 | METAP2 (0.69) | METAP2MCL1CYP2C9CYP2C19LMNA | |
| SCHEMBL28841460 | 0.78 | MCL1 (0.56) | METAP2MCL1CYP2C9CYP2C19ACLY | |
| SCHEMBL29878597 | 0.78 | MCL1 (0.56) | METAP2MCL1CYP2C9CYP2C19ACLY | |
| SCHEMBL12201322 | 0.78 | ACLY (0.60) | METAP2MCL1CYP2C9CYP2C19ACLY |
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-2006064286-A1 | CATHEPSIN S INHIBITORS | MEDIVIR UK LTD (GB) | 2006-06-22 | — | — | WO | disclosed |