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 | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.41 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 9/20 | 0.41 |
| ▸ | NOS3 | P29474 | 6/20 | 0.41 |
| ▸ | NOS1 | P29475 | 6/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 SCHEMBL30711636 | 1.00 | ADRA1D (0.45) | ADRA1DKEAP1NFE2L2VCAM1CXCL8 | |
| SCHEMBL30711675 | 0.97 | ADRA1D (0.47) | ADRA1DKEAP1NFE2L2VCAM1CXCL8 | |
| SCHEMBL27033537 | 0.97 | ADRA1D (0.47) | ADRA1DKEAP1NFE2L2VCAM1CXCL8 | |
| SCHEMBL27033816 | 0.82 | ADRA1D (0.52) | ADRA1DVCAM1MRGPRX4NOS2NOS3 | |
| SCHEMBL30711627 | 0.82 | ADRA1D (0.52) | ADRA1DVCAM1MRGPRX4NOS2NOS3 | |
| SCHEMBL28724620 | 0.80 | CRHBP (0.51) | ADRA1DCYP2C9NOS2NOS3NOS1 | |
| Bicarbonate SCHEMBL23201153 | 0.79 | ADRA1D (0.49) | ADRA1DVCAM1MRGPRX4NOS2NOS3 | |
| SCHEMBL29958664 | 0.78 | MAPT (0.46) | ADRA1DVCAM1CYP2C9MRGPRX4NOS2 | |
| SCHEMBL27033421 | 0.78 | MAPT (0.46) | ADRA1DVCAM1CYP2C9MRGPRX4NOS2 | |
| SCHEMBL23201171 | 0.76 | F2 (0.46) | ADRA1DVCAM1MRGPRX4NOS2NOS3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117396474-A | Plasma kallikrein inhibitors | 武田药品工业株式会社 | 2024-01-12 | — | — | CN | disclosed |