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 | |
|---|---|---|---|---|
| ▸ | PRNP | P04156 | 1/20 | 0.51 |
| ▸ | KLK7 | P49862 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL790264 | 0.84 | PRNP (0.53) | PRNPKLK7RXFP1IKBKBKDM4E | |
| SCHEMBL11548569 | 0.84 | IKBKB (0.63) | PRNPKLK7RXFP1IKBKBPDE3B | |
| SCHEMBL790477 | 0.83 | PRNP (0.52) | PRNPKLK7RXFP1IKBKBKDM4E | |
| Lithium SCHEMBL790479 | 0.83 | PRNP (0.52) | PRNPKLK7RXFP1IKBKBKDM4E | |
| SCHEMBL790106 | 0.76 | ADORA2A (0.55) | PRNPKLK7RXFP1KDM4EALDH1A1 | |
| SCHEMBL2310035 | 0.70 | ALDH1A1 (0.50) | RXFP1PDE3BPDE3AKDM4EALDH1A1 | |
| SCHEMBL30682029 | 0.70 | ALDH1A1 (0.50) | RXFP1PDE3BPDE3AKDM4EALDH1A1 | |
| SCHEMBL791113 | 0.69 | PRNP (0.48) | PRNPPDE3BPDE3APIK3CGHTR3E | |
| Lithium Ion SCHEMBL631871 | 0.69 | KDM4E (0.39) | IKBKBKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL789395 | 0.69 | ALDH1A1 (0.56) | KLK7KDM4EALDH1A1HPGDGLA |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |