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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 6/20 | 0.52 |
| ▸ | GMNN | O75496 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | FABP3 | P05413 | 5/20 | 0.48 |
| ▸ | CES1 | P23141 | 7/20 | 0.46 |
| ▸ | FAAH | O00519 | 4/20 | 0.46 |
| ▸ | PLA2G6 | O60733 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL3296098 | 0.96 | CES2 (0.52) | CES2GMNNTP53POLBMAPT | |
| SCHEMBL10627590 | 0.96 | CA1 (0.56) | CES2GMNNTP53POLBMAPT | |
| Zinc Ion SCHEMBL6690144 | 0.96 | CES2 (0.52) | CES2GMNNTP53POLBMAPT | |
| Succinic Acid SCHEMBL28071348 | 0.90 | CA1 (0.58) | CES2GMNNTP53POLBMAPT | |
| Dioctylsulfane SCHEMBL27376717 | 0.90 | CA1 (0.58) | CES2GMNNTP53POLBMAPT | |
| E388 SCHEMBL2936715 | 0.85 | CA1 (0.47) | CES2CA1FABP3CES1GPR84 | |
| E388 SCHEMBL20262040 | 0.83 | CA1 (0.45) | CES2CA1FABP3CES1GPR84 | |
| SCHEMBL18832134 | 0.80 | HSD17B10 (0.57) | CES2GMNNTP53POLBMAPT | |
| SCHEMBL18832148 | 0.80 | HSD17B10 (0.57) | CES2GMNNTP53POLBMAPT | |
| SCHEMBL18832128 | 0.80 | HSD17B10 (0.57) | CES2GMNNTP53POLBMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0622404-B1 | Crystalline synthetic resin composition containing a group III or IV metal salt of a cyclic organophosphoric ester | ASAHI DENKA KOGYO KK (JP) | 1998-07-08 | — | — | EP | disclosed |
| EP-0622404-A1 | Crystalline synthetic resin composition containing a group III or IV metal salt of a cyclic organophosphoric ester | ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) | 1994-11-02 | — | — | EP | disclosed |