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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL7622792 | 0.97 | TSHR (0.48) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| Lithium Ion SCHEMBL7630172 | 0.78 | TSHR (0.50) | TSHRSMN1; SMN2CYP2A6CYP1A2ACHE | |
| SCHEMBL9247778 | 0.75 | TSHR (0.53) | TSHRSMN1; SMN2CYP2A6CYP1A2ACHE | |
| SCHEMBL5494561 | 0.73 | TRPA1 (0.61) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| SCHEMBL40704 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL2017512 | 0.70 | TRPA1 (0.58) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| Bromide SCHEMBL21173634 | 0.70 | TRPA1 (0.58) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| Benzene SCHEMBL22829865 | 0.70 | TRPA1 (0.58) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| Hydrochloric Acid SCHEMBL22194330 | 0.70 | TRPA1 (0.58) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 | |
| Ammonia Solution, Strong SCHEMBL9810941 | 0.70 | TRPA1 (0.58) | TSHRSMN1; SMN2TRPA1ATMCYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5962599-A | ETHYLENE-HEXENE COPOLYMER | TOSOH CORPORATION (JP) | 1999-10-05 | — | — | US | disclosed |
| EP-0755971-A2 | Molding resin, composition containing the same, and processes for producing them | Tosoh Corporation (JP) | 1997-01-29 | — | — | EP | disclosed |