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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.68 |
| ▸ | TGM2 | P21980 | 1/20 | 0.66 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.61 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.61 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.61 |
| ▸ | KRAS | P01116 | 3/20 | 0.60 |
| ▸ | FUT5 | Q11128 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HINT1 | P49773 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL29380321 | 0.98 | NT5E (0.68) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Lithium Ion SCHEMBL30666140 | 0.98 | NT5E (0.70) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL3333972 | 0.93 | NT5E (0.70) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL2194831 | 0.93 | NT5E (0.71) | NT5ETGM2DCPSP2RY1P2RY12 | |
| SCHEMBL28001540 | 0.93 | NT5E (0.71) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL1332521 | 0.93 | NT5E (0.71) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL29480632 | 0.92 | NT5E (0.70) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL28315044 | 0.92 | NT5E (0.70) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL28593121 | 0.92 | NT5E (0.70) | NT5ETGM2DCPSP2RY1P2RY12 | |
| Gtp SCHEMBL9113739 | 0.91 | NT5E (0.72) | NT5ETGM2DCPSP2RY1P2RY12 |
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-111755744-B | Rapid lithium ion transmission material, and preparation method and application thereof | 中国科学院宁波材料技术与工程研究所 | 2024-03-12 | — | — | CN | disclosed |