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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 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 | |
|---|---|---|---|---|
| SCHEMBL5142316 | 0.95 | CYP3A4 (0.44) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| Potassium Ion SCHEMBL2701666 | 0.95 | CYP3A4 (0.44) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL2782576 | 0.95 | CYP3A4 (0.48) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL1142259 | 0.83 | CYP3A4 (0.55) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL28598227 | 0.80 | CYP3A4 (0.50) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL6928955 | 0.77 | CYP3A4 (0.46) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| Tetrabuthylammonium SCHEMBL230092 | 0.77 | CA2 (0.49) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL36647 | 0.72 | — | — | |
| SCHEMBL3865426 | 0.72 | CA2 (0.73) | CYP3A4TSHRNFKB1NPSR1CA2 | |
| SCHEMBL3958833 | 0.70 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1551893-A4 | POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION | RISEN WILLIAM M JR (US) | 2007-05-09 | — | — | EP | disclosed |
| US-20060030666-A1 | Polyurethane ionomers and methods for their preparation and formation | RISEN WILLIAM JR | 2006-02-09 | — | — | US | disclosed |
| US-6958380-B2 | Polyurethane ionomers and methods for their preparation and formation | CALLAWAY GOLF COMPANY (US) | 2005-10-25 | — | — | US | disclosed |
| US-6949604-B2 | Polyurethane ionomer blends and methods for their preparation and formation | BROWN UNIVERSITY (US) | 2005-09-27 | — | — | US | disclosed |
| EP-1551893-A1 | POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION | Risen, William M Jr. (US) | 2005-07-13 | — | — | EP | disclosed |
| WO-2004110604-A2 | POLYURETHANE IONOMER BLENDS AND METHODS FOR THEIR PREPARATION AND FORMATION | RISEN WILLIAM (US) | 2004-12-23 | — | — | WO | disclosed |
| WO-2004003047-A1 | POLYURETHANE IONOMERS AND METHODS FOR THEIR PREPARATION AND FORMATION | RISEN WILLIAM (US) | 2004-01-08 | — | — | WO | disclosed |
| US-20030199662-A1 | Polyurethane ionomer blends and methods for their preparation and formation | RISEN WILLIAM M (US) | 2003-10-23 | — | — | US | disclosed |
| US-20030109648-A1 | Polyurethane ionomers and methods for their preparation and formation | RISEN WILLIAM M (US) | 2003-06-12 | — | — | US | disclosed |