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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MET | P08581 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 6/20 | 0.45 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30835009 | 0.85 | ALDH1A1 (0.61) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL28609450 | 0.85 | ALDH1A1 (0.61) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| Lithium SCHEMBL30835026 | 0.84 | ALDH1A1 (0.60) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL12232119 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL12232118 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL19831122 | 0.82 | ALDH1A1 (0.57) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL12232117 | 0.82 | ALDH1A1 (0.68) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL12232090 | 0.82 | ALDH1A1 (0.68) | ALDH1A1HSD17B10MEN1KMT2AMET | |
| SCHEMBL19084942 | 0.81 | ALDH1A1 (0.85) | ALDH1A1HSD17B10MEN1KMT2ATSHR | |
| SCHEMBL12232089 | 0.80 | ALDH1A1 (0.69) | ALDH1A1HSD17B10MEN1KMT2AMET |
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-112961102-B | Metal complex and electron transport material using the same | 大电株式会社 | 2024-03-12 | — | — | CN | disclosed |