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 | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7575049 | 0.79 | CYP11B1 (0.41) | CYP11B1CYP11B2GAARXRARXRB | |
| SCHEMBL30364600 | 0.79 | CYP11B1 (0.41) | CYP11B1CYP11B2GAARXRARXRB | |
| Lithium Ion SCHEMBL7509524 | 0.75 | CA1 (0.48) | ALDH1A1L3MBTL1POLBKDM4E | |
| SCHEMBL25150289 | 0.73 | GAA (0.35) | CYP11B1CYP11B2GAARXRARXRB | |
| SCHEMBL30364535 | 0.73 | GAA (0.35) | CYP11B1CYP11B2GAARXRARXRB | |
| SCHEMBL4654446 | 0.72 | RXRA (0.47) | GAARXRARXRBRXRGALDH1A1 | |
| Potassium Ion SCHEMBL7521501 | 0.71 | CA1 (0.48) | ALDH1A1L3MBTL1POLBKDM4E | |
| SCHEMBL30963133 | 0.71 | CA1 (0.48) | ALDH1A1L3MBTL1POLBKDM4E | |
| Silver SCHEMBL11306037 | 0.71 | CA1 (0.48) | ALDH1A1L3MBTL1POLBKDM4E | |
| SCHEMBL7509884 | 0.71 | CA1 (0.48) | ALDH1A1L3MBTL1POLBKDM4E |
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-2002092557-A1 | METHOD FOR PRODUCING 2-TRIFLUOROMETHOXY-BENZOLE SULPHONAMIDE | BAYER CROPSCIENCE AG (DE) | 2002-11-21 | — | — | WO | disclosed |