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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.30 |
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 SCHEMBL28224844 | 0.91 | MEN1 (0.38) | LMNATSHRMEN1KMT2AALDH1A1 | |
| SCHEMBL9509397 | 0.82 | ALDH1A1 (0.37) | CA2LMNAALDH1A1 | |
| Nitromethane SCHEMBL7715140 | 0.79 | LMNA (0.38) | LMNATSHRALDH1A1MAPTPOLB | |
| SCHEMBL16546847 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL125676 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL23647292 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL10835191 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL299301 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL5668460 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL12883094 | 0.78 | CA2 (0.44) | CA2TSHRMEN1KMT2AMAPK1 |
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-109638255-A | A kind of alkali metal negative terminal surface in-situ treatment method and its application | 华中科技大学 | 2019-04-16 | — | — | CN | disclosed |